Series 1. Correspondence
Subseries 1. Incoming and outgoing mail logs
Mail log:1989 November 17 - December 29, 1989
Mail log:1990 January 2 - December 28, 1990
Mail log:1991 January 2 - December 26, 1991
Mail log:1992 January 2 - December 28, 1992
Mail log:1993 January 4 - December 29, 1993
Mail log:1994 January 3 - December 30, 1994
Mail log:1995 January 3 - December 28, 1995
Mail log:1996 January 2 - December 19, 1996
Mail log:1997 January 3 - December 16, 1997
Mail log:1998 January 5 - December 31, 1998
Mail log:1999 January 1 - December 28, 1999
Mail logs: 2004-2006 January 13, 2004-21 December 2006
Mail logs: 2007-2011 January 7, 2007-24 August, 2011
Subseries 2. General Correspondence
Correspondence 1953-1984
correspondence 1953-1954, 1956-1959
correspondence 1960-1965
correspondence 1967-1969
correspondence 1970-1975
correspondence 1976-1979
correspondence 1980-1984
Correspondence 1985
January 1985
February 1985
March 1985
April 1985
May 1985
June 1985
July 1985
August 1985
September 1985
October 1985
November 1985
December 1985
Correspondence 1986
January 1986
February 1986
March 1986
April 1986
May 1986
June 1986
July 1986
August 1986
September 1986
Correspondence 1987
January 1987
February 1987
March 1987
April 1987
May 1987
June 1987
July 1987
August 1987
September 1987
October 1987
November 1987
December 1987
Correspondence 1988
January 1988
February 1988
March 1988
April 1988
May 1988
June 1988
July 1988
August 1988
September 1988
October 1988
November 1988
December 1988
Correspondence 1989
January 1989
February 1989
March 1989
April 1989
May 1989
June 1989
July 1989
August 1989
September 1989
October 1989
November 1989
December 1989
Correspondence 1990
January 1990
February 1990
March 1990
April 1990
May 1990
June 1990
July 1990
August 1990
September 1990
October 1990
November 1990
December 1990
Correspondence 1991
January 1991
February 1991
March 1991
April 1991
May 1991
June 1991
July 1991
August 1991
September 1991
October 1991
November 1991
December 1991
Correspondence 1992
January 1992
February 1992
March 1992
April 1992
May 1992
June 1992
July 1992
August 1992
September 1992
October 1992
November 1992
December 1992
Correspondence 1993
January 1993
February 1993
March 1993
April 1993
May 1993
June 1993
July 1993
August 1993
September 1993
October 1-15 1993
October 16-30 1993
November 1-15 1993
November 16-30 1993
December 1-15 1993
December 16-31 1993
Correspondence 1994
January 1994
February 1994
March 1994
April 1994
May 1-10 1994
May 11-31 1994
June 1-15 1994
June 16-30 1994
July 1994
August 1994
September 1994
October 1994
November 1-15 1994
November 16-30 1994
December 1-15 1994
December 16-31 1994
Correspondence 1995
January 1-15 1995
January 1-15 1995
February 1-15 1995
February 16-28 1995
March 1-15 1995
March 16-31 1995
April 1-15 1995
April 16-30 1995
May 1-15 1995
May 16-31 1995
June 1-15 1995
June 16-30 1995
July 1995
August 1995
September 1995
October 1995
November 1995
December 1995
Correspondence 1996
January 1996
February 1996
March 1996
April 1996
May 1996
June 1996
July 1996
August 1996
September 1996
October 1996
November 1996
December 1996
Correspondence 1997
January 1997
February 1997
March 1997
April 1997
May 1997
June 1997
July 1997
August 1997
September 1997
October 1997
November 1997
December 1997
Correspondence 1998
January 1998
February 1998
March 1998
April 1998
May 1998
June-December 1998
Correspondence 1999
January-June 1999
July-August 1999
Correspondence 2000
January-December 2000
January-December 2001
January-December 2002
January-December 2003
January-December 2004
January-December 2005
January-December 2006
January-December 2007
January-December 2008-2010
Series 2. World Bank 1983- 2005
World Bank Mission to Brazil 1983-1984
Correspondence and travel related documents January 1983- August 1984
Working paper: World Bank sector loan to Brazil for science and technology: research and graduate training programs March 30, 1984
Staff appraisal report: Brazil sector project for science and technology June 18, 1984
Note
Appraisal report: World Bank project loan to Brazil for science and technology: research and graduate training programs July 31, 1984
Note
Staff appraisal report: Brazil sector project for science and technology August 3, 1984
Staff appraisal report: Brazil sector project for science and technology November 29, 1984
World Bank Mission to Brazil 1985
Travel related documents January 1985
Postpartum notes: Brazil sector project for science and technology January 30, 1985
Situation report: Brazil sector project for science and technology April 1, 1985
Brazil science and technology supervision mission: Loan 2489-BR July 1, 1985
First supervision mission: Aide memoire July 17-August 15, 1985
Supervision report: Brazil science and technology supervision mission Loan 2489-BR October 16, 1985
World Bank Mission to Brazil 1986
Supervision mission: Aide memoire August 11-22, 1986
Full supervision report: Brazil science and technology supervision mission Loan 2489-BR September 16, 1986
Travel related documents November 10, 1986
World Bank Mission to Brazil 1987
Notes for the World Bank midterm review mission January 18, 1987
Midterm review mission January 29, 1987
Supervision mission: Aide memoire February 11, 1987
Travel related documents June 26, 1989
World Bank Mission to Brazil 1988
Correspondence and support material October 1987- February 1988
Supervision mission: Aide memoire March 28, 1988
Full supervision report: Brazil science and technology supervision mission Loan 2489-BR March 31, 1988
Travel related documents June 1988
World Bank Mission to China 1988
Correspondence and support material September-October 1988
Travel related documents October 1988
World Bank Mission to China: May-June 1989
Travel related documents April 1989
China Key Studies Development Project: Correspondence and support material May 1989
Meetings notes May 16-June 3, 1989
China Proposed Key Studies Development Project: Aide memoire June 2, 1989
Staff appraisal report: China Key Studies Development Project July 24, 1989
World Bank Mission to Brazil: June-July 1989
Correspondence and support material October 1988- July 1989
Travel related documents June 1989
Meetings notes June 26-July 11, 1989
Notes on Brazil supervision mission July 7, 1989
Brazil science and technology supervision mission (Loan 2489-BR): Aide memoire July 12, 1989
World Bank Mission to China: September 1989
Travel related documents August 1989
Correspondence and support material August-September 1989
Meetings notes September 4-23, 1989
China Proposed Key Studies Development Project: Aide memoire September 19, 1989
World Bank Mission to Brazil: October-November 1989
Travel related documents September 1989
Correspondence and support material September- December 1989
Staff appraisal report: Brazil, Third Agricultural Research Project September 11, 1989
Note
Meetings notes October-November 1989
Chemistry and chemical engineering sub-program notes November 5, 1989
Biochemistry sub-program notes November 6, 1989
Operations basic document and operations manual November 7, 1989
Support Program for Scientific and Technological Development (PADCT): Aide memoire November 9, 1989
Support Program for Scientific and Technological Development (PADCT): Reference material I November- December 1989
Support Program for Scientific and Technological Development (PADCT): Reference material II November- December 1989
Support Program for Scientific and Technological Development (PADCT): Reference material III November- December 1989
Support Program for Scientific and Technological Development (PADCT): Reference material IV November- December 1989
World Bank Mission to Brazil 1990
Correspondence and support material May - July 1990
Travel related documents May - June 1990
Meetings notes June 1990
Support Program for Scientific and Technological Development (PADCT) Phase II: Aide memoire June 15, 1990
Staff appraisal report: Brazil, Science Research and training Project June 22, 1990
Note
Brazil Mission: Reference material June - July 1990
World Bank Mission to Mexico: January-February 1991
Travel related documents January - February 1991
Correspondence and support material January - March 1991
Meetings notes January - February 1991
Mexico Industrial Modernization and Technology Development Project: Aide memoire February 6, 1990
World Bank Mission to Mexico: June 1991
Correspondence and support material May-November, 1991
Travel related documents June 1991
Meetings notes June 1991
World Bank Mission to Brazil 1991
Correspondence and support material June- September 1991
Travel related documents August 1991
Report: Investment in Science Research and Training September 1991
Note
World Bank Mission to Mexico 1992
Correspondence and support material December 1991-January 1992
Comments on revised PACIME documents (Programa de Apoyo a la Ciencia en Mexico) January 22-24, 1992
Staff appraisal report: Mexico, Science and Technology Infrastructure Project April 30, 1992
Note
"Reglas de Operacion del PACIME" 1992
Note
"PACIME: Programa de Apoyo a la Ciencia en Mexico" 1992
Note
World Bank Mission to Brazil 1992
Correspondence and support material I April-July 1992
Correspondence and support material II August-November 1992
Travel related documents August 1992-February 1993
Meetings notes August 15-21, 1992
Supervision mission Science Research and Training Project PADCT II: Aide memoire September 1, 1992
Supervision report: Science Research and Training Project Loan 3269-BR November 18, 1992
World Bank Mission to Mexico 1993
Correspondence and support material December 1992-August 1993
Travel related documents February-March 1993
Meetings notes February 21-27, 1993
World Bank Mission to Brazil: April-May 1993
Correspondence and support material January-May 1993
Travel related documents March-May 1993
Meetings notes April 1993
PADCT I: Evaluative data final report April 1993
Supervision mission Science Research and Training Project PADCT II: Aide memoire April 16-20, 1993
World Bank Mission to Brazil: October 1993
Correspondence September 1993-January 1994
Brazil Mission: Reference material 1993
Limited supervision mission Science Research and Training Project PADCT II: Aide memoire January 8, 1994
World Bank Mission to China 1994
China Key Studies Development Project: Correspondence and support material December 1993-January 1994
Travel related documents December 1993-July 1994
Meetings notes January 1994
Mid-Term review report: China Key Studies Development Project (Cr. 2210-CHA) January 25, 1994
World Bank Mission to Brazil: January-February 1994
Travel related documents February 1994
Correspondence and support material March-June 1994
World Bank Mission to Argentina 1994
Correspondence and support material May-August 1994
Travel related documents July-September 1994
World Bank Mission to Brazil: June 1994
Correspondence and support material March-September 1994
Travel related documents May-November 1994
Project completion report on Brazil Science and Technology Project (Loan 2489-BR) June 14, 1994
Limited supervision mission Science Research and Training Project PADCT II: Aide memoire June 15, 1994
World Bank Mission to Mexico 1994
Correspondence and support material July-December 1994
Travel related documents December 1994
World Bank Mission to Brazil 1995
Correspondence May-June 1995
Travel related documents May-December 1995
Meetings notes June 1995
World Bank Mission to Mexico 1997
Correspondence and support material January-April 1997
Travel related documents January-November 1997
Meetings notes February 1997
World Bank Mission to Brazil: March 1997
Correspondence and support material February-April 1997
Project Concept Document (PCD) group meeting correspondence February-March 1997
Note
Travel related documents March 1997
World Bank Mission to Brazil: April-May 1997
Travel related documents April-May 1997
Correspondence and support material April-July 1997
World Bank Mission to China 1997
Correspondence and support material May-June 1997
Travel related documents November 1997
World Bank Mission to Mexico 1998
Correspondence and support material February-April 1998
Travel related documents March-December 1998
Mexico Science and Technology Project: Aide memoire April 22, 1998
Meetings notes April 22, 1998
World Bank Mission to Brazil: April-May 1998
Correspondence and support material November 1997-February 1998
Travel related documents April 1998
World Bank Mission to Chile: September 1998
Correspondence June 1998-June 1999
Travel related documents September 1998-November 1999
World Bank Mission to Brazil: November-December 1998
Support Program for Scientific and Technological Development (PADCT III): Reference material November 1998
Note
Travel related documents November 1999
World Bank Mission to Mexico 1999
Correspondence and support material March-May 1999
Travel related documents June 1999
World Bank Mission to Mexico 2000
Correspondence and support material June-July 2000
Travel related documents July 2000
World Bank Mission to Uganda 2003-2005
Travel related documents December 2003-April 2005
Meetings notes March 2005
Correspondence and support material March 2005
Project report: Uganda Millenium Science Intiative September 2005
Series 3. California Institute of Technology
Subseries 1. Division of Chemistry and Chemical Engineering
Division Committees
Ad Hoc Committee on Computing Needs of the Division 1978-1981
Chemical Graduate Study Committee 1992-1993
Chemical Graduate Study Committee 1994-1997
Chemical Physics Faculty Search Committee 1986
Chemical Physics Seminar (CPS) Organizing Committee, Correspondence and related material 1992, 1994-1999, 2000-2009
Chemical Physics Seminar (CPS) 1987-1990
Chemical Physics Seminar (CPS) 1991-1992, 1994-1995
Chemical Physics Seminar (CPS) 1996-1998
Chemical Physics Seminar (CPS) 1999-2003
Chemical Physics Seminar (CPS) 2004-2005
Chemical Physics Seminar (CPS) 2006-2008
Chemical Physics Seminar (CPS) 2009-2010
Chemistry Division Computing Committee 1989
Chemistry Division Computing Committee 1990-1993
Curriculum and Undergraduate Studies Committee 2000-2001
Staffing and Long Range Planning Committee 1973-1977, 1991-1997, 2001
Note
Division, Administrative Matters and miscellaneous
Graduate course in physical chemistry 1965
Post doctoral candidates 1969-1971
Post doctoral candidates 1972
Post doctoral candidates 1973
Post doctoral candidates 1974-1976
Letters of recommendation 1957-1970
Nomination of Prof. Rudolph A. Marcus for the Nobel Prize for Chemistry 1988
Division general correspondence 1983-1987
Division general correspondence 1988
Division general correspondence 1989-1990
Division general correspondence 1991-1995
Division general correspondence 1996-1998, 2001-2002
Division Faculty meetings 1989-1991
Division Faculty meetings 1992-1996
Division Faculty meetings 1998-2001, 2003-2004
Subseries 2. Institute Business
Institute Committees
Academic Freedom and Tenure Committee 1989
Note
Academic Freedom and Tenure Committee 1990-1991
Note
Administrative Committee on Supercomputers (ACS) 1985-1986
Administrative Committee on Supercomputers (ACS) 1987
Benefits Committee 2006
Caltech Campus Organization Committee 1997
Committee on Exchange Programs and Study Abroad (CEPSA) 2006
Computing Advisory Committee (CAC) 1989-1990
Computing Advisory Committee (CAC) 1991-1994
Computing Advisory Committee (CAC) 1996, 1998-1999, 2002
Faculty Management Committee (FMC) of the Caltech Concurrent Supercomputing Facilities (CCSF) 1988-1989
Faculty Nominating Committee 1988-1989
Faculty Board Steering Committee 1988-1990
Feynmann Theory Center Committee 1991
Foreign Students and Scholars Committee 1987-1991
Institute Programs Committee (IPC) 1985-1986, 1988-1991, 1994-1996
Membership and Bylaws Committee 2001-2003
Scholarships and Financial Aid Committee (SFAC) 1988-1992
Scholarships and Financial Aid Committee (SFAC) 1993-1995
Scholarships and Financial Aid Committee (SFAC) 1996-2000
Scholarships and Financial Aid Committee (SFAC) 2001-2003
Scholarships and Financial Aid Committee (SFAC) 2006-2009
Institute, miscellaneous
"An analysis of tenure granting policies" March 1977
System development Foundation Board of Trustees visit 12 December 1983
Note
Institute matters, correspondence 1984, 1989, 1993, 1997-1999
Distinguished Alumni Award nomination of Professor George C. Schatz 2005-2007
Distinguished Alumni Award nomination of Professor Donald G. Truhlar 2006-2007
Series 4. Teaching
Subseries 1. University of Illinois 1955-1963 1955-1963
Physical chemistry placement exams 1955-1959
Chemistry 240: Course outline and exams 1955-1956
Chemistry 245-246: Course outline, exams and lecture notes 1955-1959
Chemistry 342: Course outline 1956
Chemistry 344: Exams 1956-1958
Chemistry 345: Experiment instructions 1956-1957
Chemistry 347: Experiment handouts 1956-1957
Chemistry 394: Exams 1957
Chemistry 442: Course outline and exams 1963
Chemistry 445: Seminar schedule 1962
Chemistry 446: Exams and problem sets 1961-1962
Chemistry 446: Lectures notes 1961-1962
Chemistry 447: Exams and lecture notes 1961-1963
Chemistry 448: Exams and lecture notes 1960-1961
Subseries 2. California Institute of Technology 1970-2010 1970-2010
Caltech teaching 1970-1979
Chemistry 1: Course outline, exams and lecture notes 1973-1974
Chemistry 26: Experiment instructions and handouts 1977-1979
Chemistry 125: Lecture notes, problem set solutions and exams 1970
Chemistry 125: Lecture notes, problem sets and exams 1973-1976
Chemistry 135: Lecture notes, exams and problem sets 1970-1971, 1978
Chemistry 227: Course outline and lecture notes 1970-1972
Chemistry 227: Lecture notes 1976
Chemistry 227: Lecture notes I 1979
Chemistry 227: Lecture notes II 1979
Caltech teaching 1980-1989
Chemistry 125: Problem sets 1980
Chemistry 125: Lecture notes 1980
Chemistry 125: Course outline and problem sets 1981
Chemistry 125: Course outline and problem sets 1982
Chemistry 125: Lecture notes, problem sets and exams 1983
Chemistry 125: Problem sets and exams 1984
Chemistry 125: Problem sets and exams 1985
Chemistry 125: Lecture notes 1985
Chemistry 125: Lecture notes, problem sets and exams 1986
Chemistry 125: Lecture notes, problem sets and exams 1987
Chemistry 125: Course outline and problem sets 1988-1989
Chemistry 227: Lecture notes 1983, 1986, 1989
Caltech teaching 1990-1999
Chemistry 21: Course outline, lecture notes, problem sets and exams 1990-1991
Chemistry 125: Course outline, problem sets and exams 1990
Chemistry 125: Problem sets and exams 1991
Chemistry 125: Course outline, lecture notes, problem sets and exams 1992
Chemistry 125: Course outline, problem sets and exams 1993
Chemistry 125: Course outline, lecture notes, problem sets and exams 1994
Chemistry 125: Course outline, lecture notes, problem sets and exams 1995
Chemistry 125: Course outline, lecture notes, problem sets and exams 1996
Chemistry 125: Course outline, lecture notes, problem sets and exams 1997
Chemistry 125: Course outline, problem sets and exams 1998
Chemistry 125: Course outline, problem sets and exams 1999
Chemistry 135: Course outline, lecture notes and problem sets 1990-1991
Chemistry 135: Lecture notes and problem sets 1992-1993
Chemistry 135: Course outline, lecture notes and problem sets 1996-1998
Chemistry 227: Lecture notes 1993-1994, 1999
Caltech teaching 2000-2010
Chemistry 125: Course outline, problem sets and exams 2000
Chemistry 125: Course outline, lecture notes, problem sets and exams 2001
Chemistry 125: Course outline, lecture notes, problem sets and exams 2002
Chemistry 125: Course outline, problem sets and exams 2003
Chemistry 125: Course outline, lecture notes, problem sets and exams 2004
Chemistry 125: Course outline, problem sets and exams 2005
Chemistry 125: Course outline, lecture notes, problem sets and exams 2006
Chemistry 125: Course outline, problem sets and exams 2007
Chemistry 125: Lecture notes 2007
Chemistry 125: Course outline, problem sets and exams 2008
Chemistry 125: Lecture notes 2008
Chemistry 125: Course outline, problem sets and exams 2009
Chemistry 125: Lecture notes 2009
Chemistry 125: Course outline, problem sets and exams 2010
Chemistry 125: Lecture notes 2010
Chemistry 135: Course outline and problem sets 2000-2002
Chemistry 135: Course outline, lecture notes and problem sets 2003-2004
Chemistry 135: Course outline, lecture notes and problem sets 2006-2007
Chemistry 135: Course outline and lecture notes 2008-2009
Chemistry 227: Course outline and lecture notes 2003, 2005
Chemistry 227: Lecture notes 2006
Series 5. Writings and Publications
Subseries 1. Manuscripts
"Determina?ão de carga de flambagem" 1940's
Note
"Laboratóries de química analitica" 1946
Note
"Apontamentos de matemática para os exames vestibulares" 1948
Note
"Sobre o campo magnético criado por corrente elétrica" 1948
Note
"Cálculo da média geométrica na determina?ão de masses pelo método da dupla pesagem de Gauss" 1950
Note
"The Dirac vector Model" 1958
"Dimensionality in physical chemistry" 1959
"Calculations on the unimolecular decomposition of energized molecules" 1961
"Kinetics of thermal isomerization of methylcyclopropane" 1962
"Relation between threshold energy, rate constant and reaction cross section" 1965
Physical Chemistry manuscript 1968
Note
Correspondence with W.A. Benjamin related to Physical Chemistry manuscript 1964-1966
Correspondence with W.A. Benjamin related to Physical Chemistry manuscript 1967-1970
Lecture notes and transcripts January 1966-May 1967
Lecture notes and transcripts 1968
Manuscript chapters 1-2 1968
Manuscript chapters 3-4 1968
Manuscript chapters 5-6 1968
"An analysis of tenure granting policies" 1977( See: Series 3, subseries 2, Institute business)
"Anisotropic intermolecular potentials for He+CO2, He+CS2, and He+OCS from crossed beam scattering experiments" 1988
"Sensitivity analysis of the differential scattering cross section to the He+CO2 interaction potential" 1990
"An Electron impact spectroscopy investigation od diketene" 1992
Analysis of paper by Y. Ohrn and J. Linderberg entitled "Hyperspherical coordinates in four particle systems" 1992
Reviews of manuscripts and proposals of others
Reviews 1961-1964
Reviews 1965-1967
Reviews 1968-1969
Reviews 1970-1973
Reviews 1974-1977
Reviews 1978-1979
Reviews 1986-1995
Reviews 1996-1999
Reviews 2002-2008
Subseries 2. Reprints
Reprints by Aron Kuppermann
"Curso de geométria analítica" 1948
Note
"Estudo da Formula dos Hidrocarbonetos" 1948
Note
"Apontamentos de matemática para os exames vestibulares" 1949
Note
"Contribucao ao estudo do Paracoro de ciclos" 1949
Note
"Curso de geométria analítica" 1950
Note
"Exercícios resolvidos de Álgebra" 1951
Note
"Sobre a definicao e a determinacao do numero de constituintes independentes de um sistema" ; "Do uso da media aritmetica na determinacao de massas pelo metodo da dupla pesagem de Gauss" 1951
Note
"Summary of proceedings of an informal discussion on the radiation chemistry of water" 1953
"Quantum-mechanical calculation of one-electron properties: General formulation" 1958
"The quantum-mechanical calculation of one-electron properties: One- and two-center moment integrals"" 1959
"Decomposition of n-Butane in an electric discharge" 1959
Note
"Theoretical foundations of radiation chemistry" 1959
"Ferrous and ceris sulfate dosimeters" 1960
"Nonmolecular nature of the nitric-oxide thermal decomposition of n-Butane" 1960
Note
"Fundamentos da química: teoria" 1960
Note
"Diffusion kineticks in radiation chemistry" 1961
"Diffusion kinetics" 1961
Note
"Ion molecule reactions in the nitrogen-deutrium system" 1961
"Diffusion kinetick in radiation chemistry, Part I" 1962
"Diffusion kinetick in radiation chemistry, Part II" 1962
"Application of numerical methods to the theory of the periodic deviations in the Schotty effect" 1962
Note
"Determination of electronic energy levels of molecules by low energy electron impact spectroscopy" 1962
"Differences between low energy electron impact ? at large scattering angle" 1963
Note
"Electron impact spectroscopy" 1963
"Excited states produced by low energy electrons" 1964
Note
"Radiation chemistry" 1965
"Energy threshold" 1966
"Diffusion model of the radiation chemistry of Aqueous solutions" 1967
Note
"Electron impact excitation cross section for the two lowest triplet states of molecular hydrogen" 1967
"Dynamics of reaction of monoenergetic atoms in a thermal gas" 1967
Note
"Reaction of monoenergetic deuterium atoms with hydrogen molecules" 1967
Note
"Argon resonance line lamp for vacuum ultraviolet photochemistry" 1968
"Difference in the angular dependencies ? by low energy electron impact spectroscopy" 1968
"Chemical reaction cross sections and rate constants" 1968
"Vibrational energy transfer in collisions between diatomic molecules" 1968
"Formation of positive and negative ions on rhenium ? and thoriated tungsten surfaces" 1968
"Triplet states of acetylene by electron impact" 1968
"Rearrangement collisions" 1968
"A low-energy, high-resolution electron impact spectrometer" 1968
"Angular dependence of low energy electron impact excitation cross section ?" 1969
"Low-energy, high-angle electron impact spectrometer" 1969
"Applications of the statistical phase space theory to reactions of atomic hydrogen with deuterium halides" 1969
"Instrumental effects in retarding field energy analyzer" 1969
"Reactive collisions" 1969
"Differential and integral cross sections for excitation ? by electron impact" 1970
"Electron impact spectrometry" 1970
Note
"Differential elastic scattering" 1970
"Quantum mechanics of the H + H2 reaction" 1970
"Electron scattering by H2 with and without vibrational excitation" 1970
"Puzzles in the diffusion kinetics of the radiation chemistry of aqueous solutions" 1970
Note
"Linear H + H2: exact and approximate reaction probabilities" 1971
Note
"Exact tunneling calculations" 1971
"Detection and identification of triplet states of H2O by electron impact" 1971
"A test of transition state theory against exact quantum mechanical calculations" 1971
"Classical and quantum reaction probabilities and thermal rate constants ?" 1971
"Exact and approximate quantum mechanical reaction probabilities and rate constants ?" 1972
"Angular dependences of electron impact excitation cross sections of O2" 1972
"Comparison of boundry-value and initial-value methods for the accurate quantum mechanical solution of the collinear reactive scattering problem" 1972
"Angular distribution of electrons from the photoionization of ethylene" 1972
Note
"New Gas Lasers Committee Report on : Electronic transition chemically and electrically excited lasers" 1973
Note
"Interaction of low energy electrons with molecules" 1973
"Electron impact excitation of H2O" 1973
"Large quantum effects in the collinear F+H2 to FH+ H reaction" 1973
"String plucking model for vibrational excitation of molecules" 1973
"Exact quantum mechanical reaction probabilities and rate constants for the isotopic collinear H+H2 reactions" 1973
"Role of direct and resonant compound state processes ?" 1973
"Quantum initial conditions in quassi classical trajectory calculations" 1973
"Comparison of semi classical, exact quantum, and quasi classical reactive transition probabilities for the collinear H+H2 reaction" 1973
"Triplet states in 1,3-butadiene" 1973
"A direct test of the vibrationally adiabatic theory of chemical reactions" 1973
"Use of central field potentials for describing H2(D2) elastic scattering by other molecules" 1973
"Electronic spectroscopy of s-trans 1,3-butadiene by electron impact" 1973
"Central field intermolecular potentials from the differential elastic scattering of H2(D2) by other molecules" 1973
"Semi classical S matrix theory of reactive and nonreactive atom-molecule collisions" 1973
"Comparison of semi classical, quasi classical and exact quantum transition probabilities for the collinear H+H2 exchange reaction" 1973
"Violation of microscopic reversibility and the use of reverse quasi classical trajectories for calculating reaction cross sections" 1974
"Diffusion kinetics in radiation chemistry: an assessment" 1974
"An apparatus for the production of high isotopic purity deuterium" 1974
"Coplanar and collinear quantum mechanical reactive scattering ?" 1974
"Abstraction fraction in the reaction of deuterium atoms with HBr and HI" 1974
"Electronic spectroscopy of the fluoroethylenes by electron impact" 1974
"Electron impact spectroscopy of trans-azomethane" 1974
"Automatic mass-spectrometric analysis: preliminary report" 1974
"Quantum mechanical reactive scattering: an accuarate three dimensional calculation" 1975
"Electronic spectroscopy pf propadiene (allene) by electron impact" 1975
"Angular distributions in the electron impact excitation of Xe at 20 eV" 1975
"Electronic spectroscopy of trans-azomethane by electron impact" 1975
"Exact quantum, quassi classical, and semi classical reaction probabilities for the collinear F+H2 to FH+H reaction" 1975
"Exact quantum, quasi classical, and semi classical reaction probabilities for the collinear F+D2 to FD+D reaction" 1975
"A useful mapping of triatomic potential energy surfaces" 1975
"The scattering of excited by ground state atoms: application to He2" 1975
"A semi-numerical approach to the construction and fitting of triatomic potential energy surfaces" 1975
"Dynamical resonances in collinear, coplanar, and three dimensional quantum mechanical reactive scattering" 1975
"Singlet to triplet transitions in methyl-substituted ethylenes" 1975
"Surface functions for three dimentional reactive scattering" 1976
"Electron impact investigation of electronic excitation in furan, thiophene and pyrrole" 1976
"Electron impact spectroscopy of the fluoreethylenes" 1976
"Excited electronic states of ketene" 1976
"Progress in the quantum dynamics of reactive molecular collisions" 1976
"Triplet states of furan, thiophene and pyrrole" 1976
"Quantum mechanical reactive scattering for planar atom plus diatom systems: Part I- Theory" 1976
"Quantum mechanical reactive scattering for planar atom plus diatom systems: Part II- Accurate cross sections for H+H2" 1976
"Quantum mechanical reactive scattering for three dimensional atom plus diatom systems: Part I- Theory" 1976
"Quantum mechanical reactive scattering for three dimensional atom plus diatom systems: Part II- Accurate cross sections for H+H2" 1976
"An exact quantum study of vibrational deactivation by reactive and nonreactive collisions in the collinear isotopic H+HF systems" 1976
"Large quantum effects in a model electronically nonadiabatic reaction" 1976
"Validity of the adiabatic approximation for vibrational energy transfer in collisions between diatomic molecules" 1976
"Variable angle photoelectron spectrometer" 1977
"The importance of isotope dependent transmission coefficients in calculating low temperature isotope efects" 1977
"Classical dynamics of triatomic systems: energized harmonic molecules" 1977
"Angular momentum decoupling approximations in the quantum dynamics of reactive systems" 1977
"Low energy, variable angle electron impact excitation of 1,3,5-hexatriene" 1977
"Excited electronic states of fluorobenzenes by variable angle electron impact spectroscopy"" 1977
"Chemi-ionization in K-I collisions: Part I- Integral cross sections" 1978
"Chemi-ionization in K-I collisions: Part II- Differential cross sections" 1978
"Doublet to quartet transitions in nitric oxide as detected by electron impact spectroscopy" 1978
"Electron impact investigation of excited singlet states in 1,3-butadiene" 1978
"Doublet to quartet transitions in nitric oxide as detected by low energy, variable angle electron scattering" 1978
"Excited electronic states of 1,3,5-cycloheptatriene" 1978
"Detection of a second triplet state in thiophosgene by electron impact spectroscopy" 1978
"Photoelectron angular distributions of carbon-carbon Pi electrons in ethylene, benzene, and their fluorinated derivatives" 1978
"An accurate determination of the He-Ar van der Waals potential" 1978
"An empirical anisotropic intermolecular potential for He+CO2" 1978
"Electron impact spectroscopy of the alkynes" 1978
"Vibronic structure of the second triplet state of 1,3,5-hexatriene" 1978
"Electronic spectroscopy of 1,3,5,7-cyclooctatetraene by low enwrgy, variable angle electron impcat" 1978
"Electron impact excitation of low lying electronic states in CS2, OCS and SO2" 1978
"Scattering of thermal He beams by crossed atomic and molecular beams: Part I- Sensitivity of the elastic differential cross section to the interatomic potential" 1978
"Energy dependence of the differential photoelectron cross sections of molecular nitrogen" 1978
"Angular distributions in the photoelectron spectra of brenzene and its monohalogenated derivatives" 1978
"Angular distributions in the photoelectron spectroscopy of SF6" 1978
"Electronic spectroscopy of polyatomic molecules by low energy, variable angle electron impact" 1979
"An exact quantum mechanical transition state theory: Part I- An overview" 1979
"Angular distributions in the photoelectron spectroscopy of carbon monoxide" 1979
"Investigation of low-lying electronic states in nitromethane by electron impact spectroscopy" 1979
"Angular distributions in the photoelectron spectroscopy of furan, thiophene and pyrrole"" 1979
"Scattering of thermal He beams by crossed atomic and molecular beams: Part II- The He-Ar van der Waal potential" 1979
"Scattering of thermal He beams by crossed atomic and molecular beams: Part III- Anisotropic intermolecular potential ?"" 1979
"Electronic spectroscopy of UF6 and WF6 by electron impact" 1979
"Scattering of thermal He beams by crossed atomic and molecular beams: Part IV- Spherically symmetric intermolecular potential ?"" 1979
"Electronic spectroscopy of benzene and the fluorobenzenes by variable angle electron impact" 1979
"Electronic spectroscopy of 1,3-cyclopentadiene ?by electron impact" 1979
"Excited electronic states of cyclohexene ? by electron impact spectroscopy" 1979
"Comment on 'Theory of collisions between an atom and a diatomic molecule in the body fixed coordinate system" 1979
"Photoelectron spectroscopy of ethylene ? at variable angle" 1979
"Variable angle photoelectron spectroscopy of the fluoroethylenes" 1979
"Theoretical aspects of the mechanism of simple chemical reactions" 1979
Note
"Vibrational deactivation on chemically reactive potential surfaces" 1980
"Variable angle electron impact excitation of nitromethane" 1980
"Detection of the 3A2 state of CS2 by multiphoton ionization" 1980
"Hyperspherical coordinates in quantum mechanical collinear reactive scattering" 1980
Note
"Collinear quantum mechanical probabilities for the I+HI to IH+I reaction using hyperspherical coordinates" 1981
"Accurate quantum calculations of reactive systems" 1981
"Few body molecular collisions: Theoretical" 1981
"Quantum mechanical coupled channel collision induced dissociation calculations with hyperspherical coordinates" 1981
"Reactive scattering resonances and their physical interpretation" 1981
"Collision lifetime matrix analysis of the first resonance in the collinear F+H2 ?" 1981
"Collinear quantum mechanical probabilities and rate constants for the Br+HCI ... reaction using hyperspherical coordinates" 1982
"A Physical interpretation of the collinear reactive scattering resonance in the F+HD, H2, and D2 systems" 1982
"Scattering of thermal He beams by crossed atomic and molecular beams: Part V- Unisotropi intermolecular potential ?"" 1983
"Doublet to quartet and doublet to doublet electronic transitions in NO2 by electron impact" 1983
"Test of variational transition state theory against accurate quantal results for a reaction with very large reaction path curvature and a low barrier" 1984
"High energy overtone spectroscopy of some deuterated methanes" 1985
"Quantum mechanical partitioning of kinetic energy in collision-induced dissociation" 1985
"Quantum mechanical study of the reaction Be+FH (?=0,1) to BeF (?')+H" 1985
Note
"Towards a state to state transition state theory" 1985
"Collinear quassi classical trajectory study of collision induced dissociation on a model potential energy surface" 1986
"Hyperspherical coordinate formulation of the elctron hydrogene atom scattering problem" 1986
"A Test of the Babamov-Marcus Vibrationally Adiabatic Theory of hydrogene atom transfer reactions" 1986
"Three dimensional quantum mechanical reactive scattering using symmetrized hyperspherical coordinates" 1986
"Design and operation of stable intense high temperature arc-discharge source of hydrogene atoms and metastable trihydrogen molecules" 1986
"An Electron impact spectroscopy investigation of CH3 and some of its pyrolytic precursors" 1987
"Total scattering, surface ionization and photoionization of a beam of H3 metastable molecules" 1987
"Lifetime analysis of high energy resonances in three dimensional reactive scattering" 1987
"The spectroscopy of the group Vib transition metal hexacarbonyls using the electron impact method" 1987
"Electron impact spectroscopy of various diketone compounds" 1987
"Eletron impact spectroscopy of acetaldehyde" 1987
"Quantum mechanical calculation ? on a realistic potential energy surface" 1987
"Reply to comment on 'Total scattering, surface ionization and photoionization ?" 1988
"Chemical reaction dynamics" 1988
"Gaus-Jordan inversion with pivoting on the Caltech Mark II Hypercube" 1988
"Observation and analysis of emission spectra of tungsten hydride" 1988
"Mass effect quantum mechanical collision induced dissociation in collinear reactive atom diatomic molecule collisions" 1988
"Barrier height dependence of dynamics ?" 1988
"Quantum mechanical calculations ? on a realistic potential energy surface" 1988
"Collision lifetime matrix analysis of the two lowest energy resonances in the collinear H+H2 system" 1988
"The use of local hyper spherical surface functions in scattering theory" 1988
"Hyper spherical coordinate reactive scatteing using variational surface functions" 1989
"Symmetry analysis of accurate H+H2 resonances for low partial waves" 1989
"Calculation of bound rovibrational states on the first electronically excited state of the H2 system" 1990
"Numerical study of the geometric phase in the H+H2 reaction" 1990
"Quantum mechanical reactive scattering using a high performance distributed memory parallel computer" 1990
"Excited electronic potential energy surfaces and transition moments for the H3 system" 1990
"Theoretical calculation of experimentally observable consequences of the geometric phase on chemical reaction cross sections" 1991
"Prediction of the effect of the geometric phase on product rotational state distributions and integral cross sections" 1993
"The geometric phase effect shows up in chemical reactions" 1993
"A New look at symmetrized hyperspherical coordinates" 1994
"The importance of the geometric phase effect for the H+D2 to HD+D reaction" 1995
"The quantitative prediction and lifetime of a pronounced reactive scattering resonance" 1995
"Reactive scattering with row orthonormal hyperspherical coordinates: Part I- Transformation properties and hamiltonian for triatomic systems" 1996
"Hyperspherical coordinates in reactive scattering theory" 1996
"The geometric phase in reaction dynamics" 1996
"Reactive scattering with row orthonormal hyperspherical coordinates: Part II- Transformation properties and hamiltonian for tetraatomic systems" 1997
"On the geometric effect on tetra atomic reactions ?" 1998
"A Very high accuracy potential energy surface for H3" 1999
"Chemically accurate ab initio potential energy surfaces ?" 2000
"A Quantum and semi classical study of dynamical resonances ?" 2001
"Accurate first derivative nonadiabatic coupling for the H3 system" 2001
"Asymptotic analysis of state to state tetraatomic reactions using row orthonormal hyperspherical coordinates" 2001
"Hyperspherical harmonics for tetraatomic systems" 2001
"Sensitivity of the geometric phase effect to resonances, the potential energy surface, the partial wave sum, and the energy" 2001
"An optimal adiabatic to adiabatic transformation ?" 2002
"Quantum reaction dynamics for multiple electronic states" 2002
"Hyperspherical harmonics for triatomic systems" 2003
"Quantum reaction dynamics and hyperspherical harmonics" 2003
"Hyperspherical harmonics for tetraatomic systems: Part II- The weak interaction region" 2004
"Incorporating the geometric phase effect in triatomic and tetraatomic hyperspherical harmonics" 2006
"Use of symbolic algebra in the calculation of hyperspherical harmonics" 2006
"Numerical generation of hyperspherical harmonics for tetraatomic systems" 2006
"Geometric phase effects in H3 predissociation" 2007
Note
"Reactive scattering with row orthonormal hyperspherical coordinates: Part III- Hamiltonian and transformation properties for pentaatomic systems" 2009
"Influence of the geometric phase and non adiabatic couplings ?" 2009
Note
"Nondiabatic effect in the h+H2 exchange reaction ?" 2009
Note
"Analytical derivation of row orthonormal hyperspherical harmonics for triatomic systems" 2009
"Reactive scattering with row orthonormal hyperspherical coordinates: Part IV- Four dimensional space Wigner rotation function for pentaatomic systems" 2011
Reprints by others
Fausto W. Lima: "Rela?ão entre a constante de viscosidade de souders e o paracoro" 1948
Note
J.A. Breves Filho: "Deslocamentos rigidos" 1951
Note
Walter Borzani: "Fermenta?ão alcoólica contínua de mosto de mela?o" 1952
Note
Walter Borzani: "Contribu?ão ao estudo da fermenta?ão alcoólica contínua de mosto de mela?o" 1955
Note
Fausto W. Lima: "Estudo da coprecipita?ão do sitema bismuto-sulfato de chumbo com auxílio dos respectivos radioisótopos" 1955
Note
"Selecta chimica: dedicado á memória de Heinrich Rheinboldt" 1957
Note
Jörn Marz: "Mode selective bimolecular reactions" 1989
Wulfman Carl: "On the space of Eigenvectors of molecular quantum mechanics" 1994
David J. Tanner: "Semiclassical calculation of chemical reaction dynamics via wavepacket correlation functions" 2000
"Edward W. Schlag: "Charge conductivity in peptides" 2000
Series 6. Talks and Meetings
Talks given in Israel December 1968- March 1969
Note
"Test of transition state theory against exact quantum mechanical calculations," Symposium on Chemical Dynamics, University of Utah February 18-20, 1971
"Calculations on H+H2 to H2+H and the foundations of chemical kinetick," University of Florida seminar February 26, 1971
"Variable angle photoelectron spectroscopy," American Chemical Society meeting, Los Angeles, California March 28-April 2, 1971
"Propagation techniques in reactive scattering calculations," Symposium on the Theory of Chemical Reactions, Rice University April 23-24, 1971
"A Computer controlled gas chromatograph mass spectrometer system," Annual Conference on Mass Spectrometry, Atlanta, Georgia May 2-5, 1971
Caltech Symposium on Transport Theory May 6, 1971
Brazil visit (NAS-CNPq Chemistry Program) June 10-19, 1971
Note
Institute for Defense, Analyses Laser meeting, San Diego, California July 1, 1971
Gordon Research Conference on Radiation Chemistry, New Hampton, New Hampshire July 12-16, 1971
Note
"Propagation techniques in reactive scattering calculations," International Conference on the Physics of Electronic and Atomic Collisions, Amsterdam, The Netherlands July 26-31, 1971
Note
Talk to Pasadena School District science teachers August 23, 1971
"Angular distribution of electron from the photoionization of ethylene," International Conference on Electron Spectroscopy, Pacific Grove, California September 7-10, 1971
Note
"Quantum dynamics of reactive scattering," International Hot Atom Chemistry Symposium, Brookhaven National Laboratory September 7-11, 1971
"A Comparison of exact quantum classical, and semi-classical reaction probabilities," American Chemical Society meeting, Washington, D.C. September 12-17, 1971
IBM Research Laboratory meeting, San Jose, California September 16, 1971
Chemical Institute of canada, Symposium on Pulse Radiolysis, Manitoba, Canada October 25-27, 1971
"Electron impact and photoelectron spectroscopy," Society for Applied Spectroscopy, Los Angeles, California December 15, 1971
NAS-CNPq Chemistry Program meeting, Palo Alto, California January 20, 1972
American Chemical Society lecture tour March 19-24, 1972
Note
"Triplet states in the radiation chemistry of water," Conference on Elementary Processes in Radiation Chemistry, University of Notre Dame April 4-6, 1972
Xerox Corporation Research Center, Rochester, New York April 7, 1972
Brazil visit (NAS-CNPq Chemistry Program) April 15-29, 1972
"Threshold reactions of hydrogen and deuterium atoms," Gordon Research Conference on Chemistry and Physics of Isotopes, Plymouth, New Hampshire June 26-30, 1972
"Theory of energy loses of electrons by high energy radiation," Gordon research Conference on Radiation Chemistry, New Hampton, New Hampshire July 3-7, 1972
Gordon Research Conference on Dynamics of Molecular Collisions, Plymouth, New Hampshire July 24-28, 1972
Aerospace Corporation Committee on New Gas Lasers, Los Angeles, California September 20-22, 1972
"Track structure in the chemical stage," Conference on Physical Mechanisms in radiation Biology, Airlie, Virginia October 10-15, 1972
Brazil visit (NAS-CNPq Chemistry Program) November 17-28, 1972
Informal seminar, Caltech December 4, 1972
Winter Colloquium on Quantum Electronics, Snowbird, Utah January 22-24, 1973
Winter Course in gas Kineticks, Lake Arrowhead, California February 18-24, 1973
"Quantum effects in chemical reactions" ; "Quantum dynamics of chemical reactions," Indiana University and Ohio state University February 28-March 1, 1973
"Description of molecular elastic scattering by central field potentials," American Physical Society meeting, San Diego, California March 20, 1973
The Chemical Society, Faraday Division discussion on Molecular Beam Scattering, University College, London April 16-18, 1973
"Intermulecular potentials for polyatomic molecules from crossed molecular beam experiments," International Symposium on Molecular Beams, Cannes, France July 9-12, 1973
International Conference on the Physics of Electronic and Atomic Collisions, Belgrade, Yugoslavia July 16-20, 1973
Weizmann Institute of Science visit, Rehovot, Israel July 29-August 25, 1973
"Quantum effects in chemical reactions," American Chemical Society Kineticks Symposium, Chicago, illinois August 27-28, 1973
Brazil visit September 6-19, 1973
Review of the Atomic Energy Commission Research Program, Argonne National Laboratory, Illinois November 26-28, 1973
Radiological and Chemical Physics Contractors' meeting, Oak Ridge Laboratory February 14-15, 1974
Brazil visit (NAS-CNPq Chemistry Program) March 19-30, 1974
"Quantum dynamics of reactive molecular collisions," Symposium on Mathematical Aspects of Chemical and Biological Problems and Quantum Chemistry, New York April 10-11, 1974
U.S. Air Force Office of Scientific Research meeting, Air Force Academy, Colorado Springs, Colorado July 10-13, 1974
"Theories of reactive scattering," Conference on the Dynamics of Molecular Collisions, University of California at Santa Cruz July 29- August 2, 1974
Laser Induced Chemistry (LIC) meeting, University of California San Diego December 17-19, 1974
"The quantum mechanical theory of collision induced dissociation and three body recombination processes using local hyperspherical surface functions," Canadian Symposium on Theoretical Chemistry, Dalhousie University, Halifax, Canada August 7-12, 1983
"The generation and properties of a beam of metastable H3 molecules," Air Force Office of Scientific Research meeting, Albuquerque, New Mexico October 24-26, 1984
"Hyperspherical coordinates in reactive scattering," Sanibel Symposium on Atomic, Molecular and Solid State Theory, St. Augustine, Florida March 18-23, 1985
"Hyperspherical coordinates," NATO Advanced Research Workshop on The Theory of Chemical Reaction Dynamics, Orsay, France June 17-30, 1985
Air Force Office of Scientific Research meeting on Surface Chemistry, Dayton, Ohio November 4-6, 1985
"Computational chemical dynamics," Research Directors Conference, Caltech February 4-5, 1986
Air Force Office of Scientific Research meeting on Molecular Dynamics, Bedford, Massachusettes October 14-17, 1986
Orientation seminar for new graduate students, Caltech October 21, 1986
National Science Foundation meeting, washington, D.C. December 4-5, 1986
Note
"Caltech Hypercube," Research Directors Conference, Caltech February 11, 1987
GenCorp visit, Caltech February 25, 1987
Note
"Ab initio calculation of state to state reactive scattering using hyperspherical coordinates," University of Illinois at Chicago March 9-10, 1987
"Theoretical studies of the lifetime of metastable trihydrogen and tetrahydrogene," High Energy Density Matter Conference, Air Force Rocket Propulsion Laboratory, Washington, D.C. May 11-13, 1987
"The Spectroscopy and Dynamics of metastable neutral H3 molecule," Los Angeles Community College, Los Angeles, California May 15, 1987
"Quantum reaction dynamics," International Congress of Pure and Applied Chemistry, Sofia, Bulgaria July 13-18, 1987
"Accurate integral and differential, inelastic cross sections and resonance lifetimes for electron hydrogene atom scattering," International Conference on the Physics of Electronic and Atomic Collisions, Brighton, England July 22-28, 1987
"Theoretical and experimental studies of the properties and lifetime of metastable trihydrogen," High Energy Density Matter Conference, Air Force Office of Scientific Research, Newport Beach, California February 28-March 2, 1988
"Accurate quantum mechanical calculations of state to state reaction cross sections," Seminar at the University of California, Los Angeles April 18, 1988
National Science Foundation Rice University visit, Houston, Texas July 6-7, 1988
National Institute of health Special Study Section (SSS-1), Cornell University site visit, Ithaca, New York July 12-14, 1988
"Accurate Ab initio calculation of reaction cross sections using hyperspherical coordinates," International Congress on Quantum Chemistry, Jerusalem, Israel August 29-31, 1988
World Bank meeting, Washington, D.C. September 5-9, 1988
"Teoria de espalhamento de rea?oes químicas," Latin American School of Theoretical Chemistry, Rio de Janeiro, Brazil September 10-16, 1988
Note
Interamerican Development Bank (IDB) Project meeting, University of São Paulo, Brazil October 31- November 4, 1988
Parallel Concurent Supercomputing meeting, Albuquerque, New Mexico January 23-25, 1989
"The use of supercomputers in quantum mechanical reactive scattering calculations," Supercomputing Conference and User Services Group meeting, Kirtland Air Force Base, New Mexico February 7-9, 1989
"Experimental and theoretical studies of the properties of trihydrogen," High Energy Density Materials Contractors Conference, New Orleans, Louisiana March 12-15, 1989
"Calculations of scattering and bound rovibrational states of triatomic using an hyperspherical propagation method," Sanibel Simposia, St. Augustine, Florida April 4-9, 1989
Orientation seminar for new graduate students, Caltech October 17, 1989
Office of Naval research Workshop on Highly Parallel Computing for Scientific Problems, Princeton, New Jersey January 7-9, 1990
National Science Foundation meeting, Washington, D.C. March 20-22, 1990
Note
"Three dimentional reactive scattering with parallel supercomputers," Conference on Quantum Theory of Reactive Scattering, Cambridge, England March 25-27, 1990
"Chemical reaction dynamics," Intel Partners' meeting, Caltech May 31, 1990
Note
World Bank Mission to Brazil June 1-19, 1990
"Hyperspherical reactive scattering on a hypercube supercomputer," Centre Européen de Calcul Atomique et Moléculaire (CECAM) Workshop, Meudon, France July 16-August 3, 1990
"Uso de supercomputadores paralelos na teoria quantica de rea?oes químicas," University of São Paulo, Brazil August 10-26, 1990
Note
"Accurate quantum reactive scattering on parallel computers using hyperspherical coordinates," Parallel Computing for Chemical Reactivity meeting, Perugia, Italy August 29-September 2, 1990
"The Intel Delta System and the Concurrent Supercomputing Consortium," Caltech December 10, 1990
World Bank Mission, Mexico City, Mexico January 22-February 8, 1991
Gigabit Testbed Workshop, Bethesda, Maryland February 12-15, 1991
"The use of sequential and parallel supercomputer architectures in chemistry," H.C. Orsted institute, Copenhagen, Denmark March 9-16, 1991
"Quantum reaction dynamics and the potential of massively parallel computers," Harvard University May 7-8, 1991
Caltech Associates' presentation May 30, 1991
World Bank Mission to Mexico, Mexico City, Mexico June 16-29, 1991
Note
International Conference on the Physics of Electronic and Atomic Collisions, Brisbane, Australia July 7-31, 1991
World Bank Mission to Brazil August 23-September 8, 1991
Eastman Kodak/Datatape meeting, Caltech October 15, 1991
"Hyperspherical coordinates in many body collision processes," Group seminar, Caltech October 30, 1991
"Quantum chemical reaction dynamics," Gigabit Testbed meeting, Washington, D.C. November 6, 1991
"Quantum chemical reaction dynamics," Gigabit Testbed meeting, La Jolla, California January 13-15, 1992
World Bank Mission, Mexico City, Mexico January 19-25, 1992
Note
"Accurate calculation of the cross sections and rates of chemical reactions from first quantum mechanical principles using massively parallel computers," Research Directors Conference, Caltech February 6-7, 1992
"Ab initio quantum mechanic calculation of the cross sections and rates of chemical reactions," Concurrent Supercomputing Consortium Workshop, Caltech February 11-12, 1992
National Science Foundation Workshop on Supercomputer Centers, Houston, Texas March 6-8, 1992
"The Intel Touchstone Delta System: A new computational tool for large scale applications," San Diego Supercomputer Center (SDSC) Steering Committee meeting, San Diego, California March 9, 1992
"The effect of conical interactions and the geometric phase on chemical reactions," Arrhenius Rate Symposium, Jerusalem, Israel April 5-10, 1992
"The molecular Bohm-Aharonov effect in chemical reaction cross sections," Orsay, France May 12, 1992
"Thefuture of theoretical quantum reaction dynamics," Laboratoire Aimé-Cotton (LAC), Paris, France May 19, 1992
"The effect of conical interactions on chemical reaction cross sections," Observatoire de Paris, France June 4, 1992
"O futurao da dinâmica quãntica das rea?óes químics e a supercomputa?ão paralela," Universidad Federal de Pernambuco (UFPE), Recife, Brazil August 25, 1992
Note
"Hyperspherical coordinates for N- particle analysis," Group seminar, Caltech October 21, 1992
"Symmetrized hyperspherical coordinates for N-Particle systems," NATO Advanced Workshop, Assisi, Italy November 20-25, 1992
"A New experimentally observed phenomenon in reaction dynamics" the geometric phase effect," University of California, Irvine January 5, 1993
World Bank Mission to Mexico, Mexico City, Mexico February 22-27, 1993
"Opportunities and challenges of high performance computing in chemistry," National Institute of Health Workshop, Bethesda, Maryland March 8-10, 1993
World Bank Mission to Brazil April 10-22, 1993
"The use of massively parallel computer on quantum mechanical reactive scattering," Ohio State University, Columbus, Ohio June 1-3, 1993
"The geometric phase shows up in chemical reactions," Conference on the Dynamics of Molecular Collisions, Helen, Georgia June 5-10, 1993
"Dinamica das rea?óes químicas presente e futuro," Sociedada Brasileira para o Progresso da ciência, Recife, Brazil July 8-August 11, 1993
Note
New student orientation camp, Catalina Island, California September 22-24, 1993
"Investments in science and technology," University of São Paulo; and, "manifesta?ão de fase geométrica (de Berry) nas rea?ões químicas," Catholic University of Rio, Brazil October 8-16, 1993
Note
"Effect of the geometric (Berry) phase on quantum reaction dynamics," University of california, Irvine November 12, 1993
"The effect of the geometric (Berry) phase on the dynamics of chemical reactions," Annual Western States Mathematical Physics meeting, Caltech February 28, 1994
"Quantum resonances in the reaction of F atoms with HD molecules," Symposium on Chemical Dynamics in the Gas Phase, San Diego, California March 14-17, 1994
"Quantum reaction dynamics and superlinear speedup," San Diego Supercomputer Center (SDSC) Steering Committee meeting, San Diego, California March 22, 1994
"The use of massively parallel computer in quantum mechanical reactive scattering," High Performance Computing Symposium, San Diego, California April 12, 1994
"The effect of the geometric (Berry) phase in chemical reactions," American Physical Society meeting, Washington, D.C. April 21, 1994
"The geometric phase: A new quantum mechanical principle governing the dynamics of chemical reactions," Georgetown University, Washington, D.C. April 22, 1994
"The effect of the geometric phase in chemical reaction cross sections," Rutgers University, New Jersey April 26, 1994
"Quantum chemical reaction dynamics with massively parallel high performance computers" June 21, 1994
"Asymmetrized system of hyperspherical coordinates for tetra atomic reactions," Harvard-Smithsonian Center for Astrophysics, Cambridge, Massachusettes June 29 - July 3, 1994
"Adiabatic and diabatic representation for reactive scattering calculations," Argonne National Laboratory Workshop, Chicago, Illinois July 19-24, 1994
"Quantum reaction dynamics with massively parallel computers," American chemical Society Symposium on Nonadiabatic Dynamics, Washington, D.C. August 20-26, 1994
San Diego Supercomputer Center (SDSC) Executive Committee meeting, San Diego, California September 12-13, 1994
Orientation seminar for new graduate students, Caltech October 4, 1994
Corporation for National Research Initiatives CNRI) Gigabit Testbed meeting, Reston, Virginia November 1-4, 1994
Pasadena Workshop on System Software and Tools for High Performance Computing Environment, Jet propulsion Laboratory January 10-12, 1995
"Effect of the geometric phase on differential and integral reaction cross sections," University of Nevada, Las Vegas February 1-2, 1995
"Quantum mechanical reactive scattering using massively parallel high performance computers," Louisiana State University, Baton Rouge February 19-25, 1995
Martin Karplus 65th Birthday Symposium, Harvard University, Cambridge March 17-19, 1995
Note
Presentation for Intel representatives, Caltech April 5, 1995
"Hyperspherical coordinates in reactive scattering theory," Advanced Research Workshop on New Methods in Quantum Theory, Halkidiki, Greece May 11-12, 1995
San Diego Supercomputer Center (SDSC) Executive and Steering Committee meeting, San Diego, California June 12, 1995
Center for Advanced Computing Research (CACR) retreat, Fallbrock, California June 13, 1995
World Bank Mission to Brazil June 16-28, 1995
Note
"The quantitative predictions of a pronounced ? reactive scattering resonance," Conference on Reaction Dynamicd, University of Nottingham, England August 28 - September 3, 1995
"A Strong geometric phase resonance ?" European Workshop on Molecular Spectroscopy photon Induced Dynamics, Trinity College, Oxford, England September 3-7, 1995
"Time decay and lifetime analysis of reactive scattering," Group seminar, Caltech October 24, 1995
"The geometric phase and resonances in quantum reaction dynamics," University of Oklahoma, Norman April 24-26, 1996
World Bank meeting, Washington, D.C. April 29 - May 2, 1996
American Physical Society meeting, Indianapolis, Indiana May 2-5, 1996
Brazil visit June 12 - July 5, 1996
"Time dependent wave packet analysis of time dependent reactive scattering calculations," European Conference on Dynamics of Molecular Collision (MOLEC XI), Copenhagen, Denmark September 1-6, 1996
Center for Advanced Computing Research (CACR) retreat, Lake Arrowhead, California October 7, 1996
"The role of San Diego Supercomputer Center Steering Committee," Caltech October 22-23, 1996
Note
World Bank Mission to Brazil November 8-20, 1996
Modern trends in Chemical Dynamics Symposium, Taipei, Taiwan December 6-13, 1996
World Bank Mission to Mexico, Mexico City February 23-28, 1997
World Bank Mission to Brazil March 15-30, 1997
World Bank Mission to Brazil April 19- May 5, 1997
World Bank Mission to China June 2-21, 1997
"Resonances in atom-diatom chemical reactions," The Institute for Theoretical Atomic and Molecular Physics (ITAMP) Workshop, Cambridge, Massachusettes July 10-12, 1997
"The geometric phase effect formalism in tetraatomic chemical reactions," Quantum Reactive Scattering Workshop, Telluride Summer Research Center, Telluride, Colorado July 28 - August 1, 1997
World Bank Mission to Mexico, Mexico City April 13-20, 1998
"An Accurate quantum Monte Carlo potential energy surface for H3 and some of its scattering properties," The Royal Society of Chemistry, University of St. Andrews, Scitland, UK July 1-3, 1998
World Bank Mission to Chile and Brazil November 14 - December 2, 1998
Note
World Bank Mission to Chile January 23-30, 1999
Note
Boys Rahman lecture tour, England April 15 - May 4, 1999
Note
World Bank Mission to Brazil May 7-21, 1999
"Bohmian view of quantum reaction dynamics," Workshop on Quantum reaction Scattering, University of Perugia, Italy June 23 - July 16, 1999
Note
"A Bohmian view of reaction dynamics," Stanford University October 7, 1999
The National Partnership for Advanced Computational Infrastructure (NPACI) meeting, San Diego, California February 8-11, 2000
Note
"Hyperspherical coordinates in the quantum reactive scattering of three and four atom systems," Summer School on Dynamics of Molecular Collisions, Weizmann Institute of Science, Rehovot, Israel September 11-15, 2000
"A Bohmian view of quantum reaction dynamics," Conference on Dynamics of Molecular Collisions (MOLEC 2000), Jerusalem ,Israel September 17-22, 2000
Pasadena Workshop on Quantum Reaction Dynamics, Caltech January 10-13, 2001
"The importance of the geometric phase for chemical reactions," Sanibel Symposium, University of Florida, St. Augistine February 23-26, 2001
The National Partnership for Advanced Computational Infrastructure (NPACI) meeting, San Diego, California February 27-28, 2001
The National Partnership for Advanced Computational Infrastructure (NPACI) retreat, Carlsbad, California June 14-16, 2001
The National Partnership for Advanced Computational Infrastructure (NPACI) Executive Committee meeting, La Jolla, California October 31 - November 2, 2001
The National Partnership for Advanced Computational Infrastructure (NPACI) Executive Committee meeting, Houston, Texas January 23-26, 2002
World Bank Mission to Mexico, Mexico City January 28 - February 2, 2002
The National Partnership for Advanced Computational Infrastructure (NPACI) meeting, San Diego, California March 6-8, 2002
"The Bohnian interpretation of quantum reaction dynamics," The Hebrew University, Jerusalem, Israel April 24-28, 2002
Note
The National Partnership for Advanced Computational Infrastructure (NPACI) Executive Committee meeting, Marina Del Rey, California May 29-30, 2002
World Bank Mission to Brazil June 6-25, 2002
Conference on Dynamics of Molecular Collisions (MOLEC XIV), Istanbul, Turkey August 31 - September 7, 2002
The National Partnership for Advanced Computational Infrastructure (NPACI) Executive Committee meeting, Berkeley, California October 11-15, 2002
The National Partnership for Advanced Computational Infrastructure (NPACI) meeting, La Jolla, California March 17-12, 2003
The National Partnership for Advanced Computational Infrastructure (NPACI) Executive Committee meeting, Madison, Wisconsin May 29-30, 2003
"Quantum reaction dynamics and hyperspherical harmonics," Jortnerfest Symposium, Tel Aviv University, Israel June 15-17, 2003
"State to state reaction dynamics in tetratomic systems," Workshop on Quantum Reactive Scattering, El Escorial, Spain June 20-23, 2003
"Hyperspherical harmonics for triatomic and tetratomic systems," International Conference on Photonic, Electronic and Atomic Collisions (ICPEAC), Stockholm, Sweden July 23- 29, 2003
"Multiple potential energy surface quantum reaction dynamics," Workshop on Nonadiabatic Transitions in Quantum Mechanics, Moscow and Chernogolovka, Russia August 4-7, 2003
World Bank Mission to Uganda November 14-22, 2003
The National Partnership for Advanced Computational Infrastructure (NPACI) Users Advisory Committee meeting, San Diego, California April 26-28, 2004
"Symbolic computation in the determination of hyperspherical harmonic in triatomic and tetratomic systems," American Chemical Society meeting, Philadelphia, Pennsylvania August 20-28, 2004
"Hyperspherical harmonics in quantum reactive," Computational Chemical Dynamics Conference, Minneapolis, Minnesota October 6-9, 2004
Institutional evaluation of the University of São Paulo, Brazil December 2-16, 2004
World Bank Mission to Uganda March 16-26, 2005
Note
"The challenges of computational chemical dynamics," Microsoft Workshop: 'Toward 2020 Science,' Venice, Italy June 28 - July 3, 2005
"The Hamiltonian of pentaatomic system," Conference on the Dynamics of Molecular Collisions, Pacific Grove, california July 10-15, 2005
"Incorporating the geometric phase effect in hyperspherical harmonics," Workshop on Quantum Reactive Scattering, University of California, Santa Cruz July 15-19, 2005
American Chemical Society meeting, Washington, D.C. August 27-31, 2005
"Accurate reactive scattering calculations using hyperspherical harmonics," Symposium on Atomic and Molecular Chemixstry and Physics, University of Southern California September 23-24, 2005
"Relation between time-dependent and time-independent formalisms of poly-atomic reactive scattering," Dalian Institute of Chemical Physics, China June 29 - July 13, 2006
"Exact quantum theory of chemical reactions and their resources," American Chemical Society meeting, San Francisco, California September 8-15, 2006
"Hamiltonian of a pentaatomic system in row orthonormal (democratic) hyperspherical coordinates," International Workshop on Quantum Reactive Scattering, Cambridge, England July 4-24, 2007
"Pursuing the holy grail of theoretical chemical dynamics," Physical Chemistry seminar, University of California, Davis November 5-7, 2007
"Democratic hyperspherical coordinates for five atoms and beyond," Conference on Computational Molecular Structure and Dynamics, Austin, Texas January 8-10, 2009
External evaluation Panel for Chile's Centers of Excellence, Santiago de Chile March 8-11, 2009
George C. Schatz 60th Birthday Conference, Evanston, Illinois April 16-19, 2009
"Angular momentum operatorsin multidimentional spaces in the theory of reactive scattering of polyatomic systems," International Workshop on Quantum Reactive Scattering, Dalian, China June 5-10, 2009
Series 7. Research Files
Subseries 1. Research proposals and grants
Air Force Office of Scientific Research (AFOSR) 1973-1988
AFOSR general correspondence March 1973- April 1979
Application for renewal of research grant: "Theories of energy disposal in chemical reactions" March 1974
Note
Application for renewal of research grant: "Theories of energy disposal in chemical reactions" March 1975
Revised budget for research project AFOSR-73-2539 25 April 1975
Application for renewal of research grant: "The quantum dynamics of chemical reactions" February 1978
Note
Application for renewal of research grant: "The quantum dynamics of chemical reactions" March 1979
Final scientific report: "The quantum dynamics of chemical reactions" 14 March 1980
Final technical report: "The quantum dynamics of chemical reactions" 31 March 1983
Reference material for inal technical report: "The quantum dynamics of chemical reactions" 31 March 1983
Application for a research grant: "The dynamics of simple chemical reactions- theory and experiment" 17 January 1985
Application for a research grant: "Quantum dynamics of chemical reactions" 30 January 1986
Request for a research grant: "High energy products from high energy reagents" 29 November 1988
Air Force Rocket Propulsion Laboratory (AFRPL) 1985-1991
Request for AFRPL research grant: "Tetrahydrogen" 13 March 1985
AFRPL general correspondence August 1985-October 1987
Final technical report: "Tetrahydrogen" 15 October 1986
Note
Final report: "Tetrahydrogen" January 1987
Note
Request for AFRPL research contract: "Theoretical studies of the lifetime of metastable trihydrogen and tetrahydrogen" 29 April 1986
Note
AFRPL correspondence (grant FO4611-86-K-0067) April 1986-August 1991
Technical progress reports (grant FO4611-86-K-0067) 1 August 1986-1July 1989
Budget status reports (grant FO4611-86-K-0067) March 1987-September 1991
Final technical report: "Theoretical studies of the lifetime of metastable H3" 30 April 1990
Note
Request for AFRPL research contract: "Experimental studies of the properties of trihydrogen and tetrahydrogen" 29 April 1986
Note
AFRPL correspondence (grant FO4611-86-K-0076) April 1986-March 1991
Technical progress reports (grant FO4611-86-K-0076) 1 August 1986-1July 1989
Budget status reports (grant FO4611-86-K-0076) June 1987-December 1990
Final technical report: "Experimental studies of the properties of trihydrogen and tetrahydrogen" 28 February 1990
Atomic Energy Commission, United States (USAEC) 1958-1975
Final technical report: "Studies in radiation chemistry and chemical kinetics" 15 November 1958-15 December December 1963
Note
Application for a research contract: "Studies in chemical kinetics and radiation chemistry" 31 May 1963
Note
Revision to application for a research contract: "Studies in chemical kinetics and radiation chemistry" (AT (04-3)-532) October 1963
Technical progress reports (AT (04-3)-532) July 1964
Application for renewal of research contract: "Studies in chemical kinetics and radiation chemistry" 10 August 1964
Request for supplemental funds for contract (AT (04-3)-532) 2 October 1964
Revision to application for renewal of research contract: "Studies in chemical kinetics and radiation chemistry" (AT (04-3)-532) 8 October 1964
Technical progress reports (AT (04-3)-532) July 1965
Application for renewal of research contract: "Studies in chemical kinetics and radiation chemistry" September 1965
Technical progress reports (AT (04-3)-532) 8 August 1966
Note
Technical progress reports (AT (04-3)-532) 31 August 1967
Note
Application for renewal of research contract: "Studies in chemical dynamics and radiation chemistry" September 1967
Technical progress report (AT (04-3)-532): Draft July 1968
Technical progress report (AT (04-3)-532): Final 6 September 1968
Note
Application for renewal of research contract: "Studies in chemical dynamics and radiation chemistry" September 1968
Technical progress report (AT (04-3)-767, PA No. 4 1 July 1969
Application for renewal of research contract: "Studies in chemical dynamics and radiation chemistry" September 1969
Technical progress reports (AT (04-3)-767, PA No. 4 30 June 1970
Note
Application for renewal of research contract: "Studies in chemical dynamics and radiation chemistry" September 1970
Application for renewal of research contract: "Studies in chemical dynamics and radiation chemistry" September 1971
Technical progress report (AT (04-3)-767, PA No. 4 July 1972
Note
Application for renewal of research contract: "Studies in chemical dynamics and radiation chemistry" September 1972
Application for renewal of research contract: "Studies in chemical dynamics and radiation chemistry" 27 June 1973
Technical progress report (AT (04-3)-767, PA No. 4 30 June 1973
Note
Technical progress reports (AT (04-3)-767, PA No. 4 July 1973
Note
Application for renewal of research contract: "Studies in chemical dynamics and radiation chemistry" 3 July 1974
Technical progress reports (AT (04-3)-767, PA No. 4 July 1974
Note
Technical progress report (AT (04-3)-767, PA No. 4 31 July 1975
Energy, Department of (DOE) 1978-1989
Application for renewal of research contract: "Studies in chemical dynamics" 22 November 1978
Technical progress report: Studies in chemical dynamics" (DE-AT03-76ER72004) 26 November 1979
Note
Technical progress report: "Studies in spectroscopy and chemical dynamics" (DE-AT03-76ER72004) 1 November 1981
Proposal renewal and related correspondence October 1983-April 1989
Request for a renewal of a research contract with the U.S. Department of Energy: "Studies in spectroscopy and chemical dynamics" 15 October 1984
Technical progress report: "Studies in spectroscopy and chemical dynamics" (DE-AT03-76ER72004) 15 October 1984
Request for a renewal of a research contract with the U.S. Department of Energy: "Studies in spectroscopy and chemical dynamics" 15 October 1985
Technical progress report: "Studies in spectroscopy and chemical dynamics" (DE-AT03-76ER72004) 15 October 1985
Technical progress report: "Studies in spectroscopy and chemical dynamics" (DE-AT03-76ER72004) 15 November 1986
Proposal: "Electron impact spectroscopy and chemical dynamics of free radicals" 20 November 1986
Proposal: "Instrumentation for reaction dynamics of combustion processes" December 1986
National Science Foundation (NSF) 1977-2006
Application for a research grant: "The study of dynamical resonances in chemical reactions" July 1977
Revised budget for research grant: "The study of dynamical resonances in chemical reactions" 24 February 1978
Request for an instrumentation grant: "Intermediate size departmental computer for structural and dynamics studies of chemical processes"( See also: Series 3, Caltech cemistry Ad Hoc Committee on Computing Needs of the Division) 1 August 1978
Proposal: "Equipment for undergraduate physical chemistry laboratory" 23 February 1979
Proposal: "An attached array processor for the departmental computer for structural and dynamic studies of chemical processes" 16 April 1982
Proposal: "State to state reaction cross sections for hydrogen atom abstraction reactions" 18 May 1984
Proposal to NSF Office of Science and Technology Centers Development: "Center for Scientific Parallel Programing" January 1988
Proposal correspondence: "Center for Research on Parallel programing (CRPC)" February-December 1989
Center for Research on Parallel programing (CRPC) budget account reports March 1989-August 1991
Proposal: "Electronically non adiabatic effects in state to state reaction dynamics using massively parallel supercomputers" (CHE-9311401) 2 February 1993
Proposal correspondence: "Electronically non adiabatic effects in state to state reaction dynamics using massively parallel supercomputers" July 1983-May 1995
Proposal renewal (continuation of CHE-9311401) 1 February 1996
Proposal renewal and related correspondence January 1998- December 2000
Proposal: "Parallel I/O methodologies for I/O intensive grand challenge applications" 15 June 1993
Note
Proposal related correspondence March 1993-December 1997
Proposal: "Graduate research trainship in high performance computational chemistry and biology" March 1994
Proposal to NSF Partnership for Advanced Computational Infrastructure Program (NPACI), Solocitation No. NSF 96-31 July 1996-June 2003
Note
NPACI proposal renewal 17 March 1999
NPACI proposal renewal 7 March 2003
NPACI proposal renewal 29 September 2003
Proposal: "Chemistry Research Instrumentation and Facilities (CRIF)" September 1996
Note
Proposal: "Quantum reaction dynamics of triatomic, tetratomic, and larger polyatomic systems including electronically non adiabatic effects" (CHE-0138091) August 2001
Proposal renewal : "Quantum reaction dynamics ... including electronically non adiabatic effects" (CHE-0138091) January 2007
Pre proposal no. 0647490: "Collaborative research, geometric dimension reduction of complex molecular systems" August 2006
Proposals, Miscellany 1977-1993
Beckman Institute proposal: "Calculation of four center reaction cross sections and rate constants" July 1992
Caltech Consortium in Chemistry and Chemical Engineering proposal: "Reaction dynamics of metastable H3" March 1989
Caltech Consortium in Chemistry and Chemical Engineering proposal: "Calculation of reaction cross sections and rate constants on the Caltech DELTA parallel supercomputer" April 1991
Caltech President Fund proposal: "Pulsed ultraviolet laser photoacoustic spectroscopy" January 1979
Caltech President Fund proposal: "Investigation of a CCD multichannel detector for an electron spectrometer" December 1982
Camille and Henry Dreyfus Foundation proposal: "An attached array processor for the Dreyfus-NSF Theoretical Chemistry Computer" December 1982
Department of the Army, Army Research Office (ARO) proposal: "Reaction dynamics of metastable states" August 1990
Department of Defense proposal: "An attached array processor for the Dreyfus-NSF Theoretical Chemistry Computer" November 1982
IBM Shared University Research Program proposal: "An IBM RISC system workstation" May 1993
U.S.-Israel Binational Science Foundation proposal: "The quantum dynamics of electron transfer chemical reactions" June 1977
Subseries 2. Technical Files
Systems of coordinates for linear A plus B to AB plus C April 1970
An attempt at pre-averaging rotational states August 1970
Reactive scattering in three physical dimensions September 1971
Reaction on a plane transformation of coordinates I April-May 1973
Reaction on a plane transformation of coordinates II April-May 1973
Notes on potential energy surface globe May 1973
Polar plots May 1973- January 1974
Reaction on a plane transformation of coordinates III June 1973
Three dimensional reactive scattering I June 1973
Three dimensional reactive scattering II June 1973
Three dimensional reactive scattering III June 1973
Three dimensional reactive scattering by the separate arrangement channel method January 1974
Polar plots October 1974
Probability current density for 3-D atom diatom reactive scattering I December 1974- January 1975
Probability current density for 3-D atom diatom reactive scattering II December 1974- January 1975
Quantum theory of molecular reactions June 1975
Coupling of electronic and nuclear motion November 1976
De Broglie maps for scattering and bound state problems July 1977
A simple model for dissociative collinear collisions October 1977
Systems of coordinates in 6D configuration space appropriate for atom diatom reactive scattering II October 1977-January 1978
Systems of coordinates in 6D configuration space appropriate for atom diatom reactive scattering II October 1977-January 1978
Considerations about symmetry April 1978
Considerations about improvements in 3D reactive scattering calculations May 1978
Determination of surface Eigen functions I September-October 1979
Notes on integration of systems October 1979
Determination of surface Eigen functions II November-December 1979
Determination of surface Eigen functions III Decenber 1979- January 1980
Determination of surface Eigen functions IIII February-March 1980
Determination of surface Eigen functions IV September 1980
Invariant imbedding in reactive scattering I January 1981
Invariant imbedding in reactive scattering II
Considerations about the solution of the logarithmic deriative equation without and with a first order term April-May 1981
Generalized symmetrized hyperspherical coordinates June 1981
Boundary conditions for symmetric Eigen value problems September 1981
Symmetry surface functions December 1981
Summary of group theory January-February 1982
Symmetrized hyperspherical coordinates for N-body systems June 1982
Collinear three body recombination I August-October 1982
Collinear three body recombination II October 1982-January 1983
Collinear three body recombination III November 1982
Two electron problems in hyperspherical coordinates December 1982
The asimptotic behavior of surface functions January 1983
Relation between symmetry and general matrices April 1983
Bound states by scattering methods April 1983
Considerations about angular momentum operators and derivation of body-fixwd scattering equations for N-particle systems April 1983- July 1984
Local scattering matrices in hyspherical coordinates May 1983
ymmetry considerations about the mapping of the potential energy function of four collinear atoms May 1983
Phase space weight in hyperspherical coordinates February 1984
Properties of logarithmic derivative matrix September 1984
Considerations about uniqueness of scattering and surface functions for triatomic systems January 1985
Bound states of particle on a circular slotted wheel potential February 1985
Constants of the motion for orthogonal coordinates March 1985
State to state cross sections in electron hydrogene atom scattering April 1985
Relation between scattering amplitude and scattering matrix May 1985
Considerations about matching wave functions November 1985
Possible methods for calculating surface functions in triatomic chemical reactions January 1986
Non orthogonality of transformation from space fixed mass scaled cartesian coordinates to body fixed spherical coordinates June 1986
Orthogonality of surface functions December 1986
High energy density matter May 1987
Boundry conditions November 1987
Behavior of body fixed surface functions
Wigner rotation matrices as a representation of the 3-D rotation group December 1987
Scattering theory with local hyperspherical surface functions October 1988
Independent 5-D reference functions December 1989
General treatment of geometric phase effect I March 1991-March 1996
General treatment of geometric phase effect II March 1991-March 1996
General treatment of geometric phase effect III March 1991-March 1996
A new look at symmetric hyperspherical coordinates I August 1991-February 1992
A new look at symmetric hyperspherical coordinates II August 1991-February 1992
A new look at symmetric hyperspherical coordinates III August 1991-February 1992
Comparison of different principal axis of inertia hyperspherical coordinate systems I September 1991
Comparison of different principal axis of inertia hyperspherical coordinate systems II September 1991
Comparison of different principal axis of inertia hyperspherical coordinate systems III September 1991
Comparison of forward and reverse exact transition state transmission coefficients January 1992
Geometrical properties of the maps of 4-particle systems March-May 1992
Commutation between coordinate transformations and function operators May 1992
Construction of row-orthogonal matrices of dimensions 3 times N May-June 1992
N-particle Hamiltonian in principal moment of inertia frame I May-August 1992
N-particle Hamiltonian in principal moment of inertia frame II May-August 1992
General considerations about the N-particle Hamiltonian in principal moment of inertia hyperspherical coordinates I August 1992-November 1995
General considerations about the N-particle Hamiltonian in principal moment of inertia hyperspherical coordinates II August 1992-November 1995
General considerations about the N-particle Hamiltonian in principal moment of inertia hyperspherical coordinates III August 1992-November 1995
General considerations about the N-particle Hamiltonian in principal moment of inertia hyperspherical coordinates IV August 1992-November 1995
General considerations about the N-particle Hamiltonian in principal moment of inertia hyperspherical coordinates V August 1992-November 1995
Transformations of coordinates in Jacobi matter form October 1992
The Born-Oppenheimer expansion in mass scaled Jacobi coordinates December 1992-September 1995
Relation between adiabatic and diabatic representations January 1993
Symmetry analysis of collinear triatomic reactive scattering February 1993
Symmetry decomposition for collinear triatomic reactions February 1993
Consideration about 2MD and 5MD basis functions and their symmetries March-April 1993
Estimate of the effect of narrow resonances on collinear rate constants May 1993
Diabatization procedure for the first two electronic state of H3 September 1993-January 1994
One dimensional basis sets November 1993
Rederivation of some formulas of Bowman chapter December 1993
Some thoughts on the calculation of the gain for the concurrent use of two computers linked by a network January 1994
The shapes of intersecting potential energy April 1994
Bohm's mechanics applied to molecular systems April 1994
Diabatization procedure May 1994-October 1995
A new switching function January 1995
Analysis of the poles of triatomic systems in row orthonormal coordinates February 1995
Pack's rotationary quasi adiabatic expansion February 1995
Timedelay analysis of multichannel scattering problems February-April 1995
Decomposition of the multichannel scattering amplitude into hard-sphere potential and resonant parts March-April 1995
Relation between Yarkoni and hyperspherical coordinates and matrix elements June 1995
Relation between space fixed and body fixed gradients for N-particle systems September 1995
The adiabatic to diabatic transformation for conical intersections angle September 1995-September 1996
Considerations about external and internal angular momenta October 1995
Single valuedness and boundary conditions issues January-April 1996
Angular momentum operators March 1996
The 3-body hamiltonian April-July 1996
Relation between principal axes of inertia and Jacobi body fixed hyperspherical coordinate operators May 1996
The 3 and 4-body Hamiltonian May 1996
The 4-body Hamiltonian September 1996
The chain rule in matrix form October 1996-February 1997
Singular value decomposition October 1996
Thoughts about matrix form of gradient operator October 1996
Hyperspherical coordinates for H3 November 1996
Partial wave expansion in row-orthonormal hyperspherical coordinates for 3 and 4 body systems December 1996
Single valuedness and continuity for nuclear wave functions of triatomic and tetraatomic systems January 1997
Transformations issues January-August 1997
A possible change of the row orthonormal hyperspherical coordinates March 1997
Reactive scattering with row orthonormal hyperspherical coordinates I March 1997
Reactive scattering with row orthonormal hyperspherical coordinates II March 1997
Orthogonality of the Jacobi coordinate transformation July 1997
Boundary conditions in the decomposition of a vector field into longitudial and transverse components October 1997
Symmetry properties of diabatic wave functions November-December 1997
H3 coupling tables November 1997-February 1998
Coupling calculations February 1998
Mixing classical and quantum mechanics May 1998
Individual particle properties and statistical ensemble averages in classical and quantum mechanics July 1998
Hyperspherical harmonics for tetraatomic systems January-July 2000
Considerations about generalized angular momentum operator March 2000
The Hamiltonian for N-body systems in row-orthogonormal hyperspherical coordinates April 2000
Hamiltonian for N-body systems in row-orthonormal hyperspherical coordinates May-July 2000
Body fixed and space fixed angular momentum operators May 2000
Parity properties of the ROHC harmonics March 2001
Geometric phase effect in tetraatomics May 2001
Comparison of effects of pseudo rotations and inversions on triatomic and tetraatomic systems July 2001
Hyperspherical harmonics in weak interaction region for tetraatomic systems October 2001-February 2004
Triatomic and tetraatomic hyperspherical harmonics including the geometric phase effect I July 2002
Triatomic and tetraatomic hyperspherical harmonics including the geometric phase effect II July 2002
Triatomic and tetraatomic hyperspherical harmonics including the geometric phase effect III July 2002
Triatomic and tetraatomic hyperspherical harmonics including the geometric phase effect IV July 2002
Triatomic and tetraatomic hyperspherical harmonics including the geometric phase effect V July 2002
Triatomic and tetraatomic hyperspherical harmonics including the geometric phase effect VI July 2002
Triatomic and tetraatomic hyperspherical harmonics including the geometric phase effect VII July 2002
Coordinations about angular momentum operations January 2003
The Hamiltonian in ROHC July 2003
The hyperadius dependence of surface functions in the asymptotic region March 2004
Hyperspherical harmonics in weak interaction region for tetraatomic systems October 2004
A new look at hyperspherical harmonics for triatomic systems with and without the geometric phase December 2004
An improved reference potential for the atom triatom weak interaction region March 2005
Analysis of tetraatomic systems September 2005
Considerations about a backword integrator to generate physical wave functions November 2006
The angular momentum commutation relations in 3D and 4D spaces August-December 2007
An alternate set of angular momentum operators for 3 and 4 body systems March-April 2008
Relation between Mukhtarova and Efros and Wang and Kuppermann triatomic hyperspherical harmonics March-May 2008
Considerations about changes of variables in the evaluations of scalar product February 2009
Series 8. Computing
Subseries 1. San Diego Supercomputer Center (SDSC)
San Diego Supercomputing Center Committees
SDSC Steeing Committee meetings 1985
SDSC Steeing Committee meetings 1986-1988
SDSC Steeing Committee meeting March 1991
SDSC Steeing Committee meeting June 1991
SDSC Steeing Committee meeting March 1992
SDSC Steeing Committee meeting December 1992
SDSC Steeing Committee meeting March 1993
SDSC Steeing Committee meeting September 1993
SDSC Steeing Committee meeting March 1994
SDSC Steeing Committee meeting September 1994
SDSC Steeing Committee meeting March 1995
SDSC Steeing Committee meeting June 1995
SDSC Steeing Committee meeting September 1995
SDSC Steeing Committee meeting December 1995
SDSC Steeing Committee meeting March 1996
SDSC Steeing Committee meeting June 1996
SDSC Allocation Committee meetings 1985-1991
SDSC Allocation Committee meetings 1992-1993
San Diego Supercomputing Center Proposals
"Caltech Concurrent Computation Program: use of the Cray-2 for scientific Computation" 1987-1988
"Ab initio calculation of reaction cross sections" 1987-1988
"Ab initio calculation of reaction cross sections" 1989-1991
"Ab initio calculation of reaction cross sections on parallel supercomputers" 1992-1993
"SDSC Consortium parallel computing proposal 1992-1993
"Ab initio calculation of reaction cross sections and quantum mechanical streamlines for atom-diatom reactions" 1994-1995
National Partnership for Advanced Computational Infrastructure (NPACI) proposals 1998-2001
National Partnership for Advanced Computational Infrastructure (NPACI) proposals 2002-2005
"Quantum state to state reaction dynamics" 2006-2008
"Quantum state to state reaction dynamics" 2009-2011
San Diego Supercomputing Center miscellany
Time allocationon SDSC Cray 1986-1987
Time allocationon SDSC Cray 1988-1989
Time allocationon SDSC Cray 1990-1997
SDSC correspondence 1985-1997
Subseries 2. Intel Delta Parallel Supercomputer
Concurrent Supercomputing Consortium (CSC), Group on Parallel Supercomputing Applications Consortium at Caltech (PSACC) 1990-1993
News clippings related to the Concurrent Supercomputing Consortium's acquisition of the Intel Touchstone Delta System 1990
Allocation policy for Intel Delta System 1990-1991
Intel Delta dedication May 31, 1991
Delta Parallel Supercomputer Policy Committee 1991-1993
Intel Delta user group meetings 1991-1992
Intel Delta\Gamma applications 1991-1994
Intel Delta\Gamma time allocation 1991-1994
Intel Delta\Gamma allocation usage 1991-1994
Proposal: "Calculation of reaction cross sections and rateconstants on the Caltech Delta parallel supercomputer" 1991-1993
Proposal: "Institute for High-Performance Computing (IHPC)" 1993
Subseries 3. Caltech Concurrent Computation Program (CCCP)
CCCP financial matters 1985-1986
CCCP reports 1985-1986
CCCP reports 1987-1988
CCCP review: "Quantum chemical reaction dynamics with concurrent processors" 1988
CCCP research funds 1990-1992
Correspondence regarding the Center for Research on Parallel Computation (CRPC) 1990-1994
Correspondence regarding the Center for Advanced Computing Research (CACR) 1994-1996
Caltech Computational Research, selected projects 1995
Subseries 4. JPL\Caltech Supercomputing Project
Cray X\MP Project 1992
Cray X\MP Project 1993-1994
Cray X\MP Project 1995
Cray X\MP Project 1996-1998
JPL Cray computer time allocation 1998-1999
JPL Cray computer time allocation 2000-2001
CASA Gigabit Network
CASA Network plan 1990
Report: "CASA Gigabit Network Testbed: Quantum chemical reaction dynamics" 1991
CASA applications workshop 1992
CASA correspondence 1990-1992
CASA correspondence 1993-1994
Series 9. Biographical and Personal Material
Biographical sketch (several versions) 1955, 1980, 1984, 1989, 1991, 1993, 1998, 2006
Curriculum vitae 1959-1960
Note
Curriculum vitae 1962, 1968, 1976, 1978, 1980, 1984, 1992, 2002
Faculty profile statements 1963, 1970, 1991-2006
List of publications 1984, 1993, 2010-2011
List of publications on theoretical topics 1989, 1993
"Ten most significant experimental contributions of Aron Kuppermann: 1960 through 1977" 1978
"Ten most significant theoretical contributions of Aron Kuppermann: 1963 through 1977" 1978
"Ten most significant experimental and theoretical contributions of Aron Kuppermann: 1963 through 1977" 1978
"An account of Aron kuppermann's scientific contributions from September 1955 through December 1978" 1979
"Aron Kuppermann's most important scientific contributions" 1982
"An account of Aron kuppermann's contributions to theoretical chemistry" 1989
Consulting files
Varian Associates 1965-1967
TRW Systems Corporation 1971-1976
Jet Propulsion Laboratory 1979
International Advisory Panel, Chinese University Development Project 1983-1986, 1991
Education and early science
University of Sao Paulo: Mathematical physics 1952
University of Edinburgh: Exercises in quantum theory 1953 January-March
University of Edinburgh: Nuclear physics January-March 1953
University of Edinburgh: Quantum mechanics January-March 1953
University of Edinburgh: Electronics April 1953
Atomic Energy Research Establishment (AERE), England: Isotope School July-August 1953
Note
Seminar on Bohm's paper 1953
Note
University of Notre Dame: Quantum theory 1953-1954
University of Notre Dame: Chemistry notebook 1953-1954
University of Notre Dame: Electrodynamics 1953-1954
University of Notre Dame: Problems in physical chemistry 1953-1954
University of Notre Dame: Ph.D. dissertation August 1955
Note
Instituto de Energia Atomica, Brazil: Radiation Chemistry 1959-1960
University of Illinois: Physics 482 1963
Caltech: Physics 205 1972-1973
Note
Biographical listings
American Chemical Society Directory of Graduate Research 1961, 1965-2001
American Men and Women in Science 1972, 1975, 1978, 1981, 1991, 2002
American Men of Science 1965
Dictionary of International Biography 1970
Men of Achievement 1970
National Register of prominent Americans 1973
The Blue Book (publication) 1969
Who's Who in America 1966-1967, 1969, 1971, 2003
Who's Who in American Education 1969
Who's Who in Atoms 1962, 1964
Who's Who in Frontiers of Science and Technology 1985
Who's Who in Technology Today 1982
Who's Who in the West 1967, 1969-1970
Who's Who in the World Jewry 1969
World Who's Who in Science 1967
Awards and Honors
The National Chemistry Honor Society, Phi Lambda Upsilon 1956
Richard M. Badger Teaching Prize, Caltech 1996
Sigma Xi honorary membership 1997
Royal Society of Chemistry Award: S.F. Boys- A Rahman Lectureship 1998-1999
Caltech Graduate Student Council Excellence in Teaching Award 1999
News clippings, articles and interviews
Caltech News December 1975
Note
Ambassador College report May 29, 1905
Los Angeles Times May 13, 1979
Pasadena Star News November 13, 1990
Engineering & Science 1996
Caltech Oral History project 2001
Personal, Miscellany
Correspondence regarding joining Caltech 1962-1964
Leave of absence 1968-1969
Leave of absence 1976-1977
Leave of absence 1984
Leave of absence 1992
Leave of absence 1998
Portrait photos 1979, 1997
Copy of Kuppermann's birth certificate (in Portuguese) 1959
Kuppermann's 75th birthday celebration, Caltech March 30-31, 2001
Kuppermann's obituaries 2011
Kuppermann's Memorial Symposium, Caltech October 23, 2012
Caltech, Miscellany
List of past graduate students 1968, 1983, 1985, 2012
Research group social activities 1987, 11989, 1999
Research group contact information list 1991-1992, 1996
Research group calendar November 1998- March 2000
Office procedures 2003
Kuppermann's blank letterheads undated
Kuppermann's Web page printouts 2010
Appointment books 1991-1994
Appointment books 1995-1998
Appointment books 1999-2001
Appointment books 2002-2004, 2006