Buenker, Robert J: search on Z-Library

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1

Molecular geometry and the Mulliken-Walsh molecular orbital model. Ab initio study

Buenker, Robert J., Peyerimhoff, Sigrid D.

Journal:

Chemical Reviews

Year:

1974

Language:

english

File:

PDF, 6.88 MB

english, 1974

2

Application of relativity theory to the global positioning system

Buenker, Robert J.

Journal:

Year:

2014

Language:

english

File:

PDF, 115 KB

english, 2014

3

Degree of freedom in the Lorentz transformation

Buenker, Robert J.

Journal:

Year:

2013

Language:

english

File:

PDF, 81 KB

english, 2013

4

Non-adiabatic coupling matrix elements for large CI wavefunctions

Gerhard Hirsch, Pablo J. Bruna, Robert J. Buenker, Sigrid D. Peyerimhoff

Journal:

Chemical Physics

Year:

1980

Language:

english

File:

PDF, 968 KB

english, 1980

5

Configuration interaction study including the effects of spin–orbit coupling for the electronic states of the LiX molecules (X = C, Si, Ge, Sn)

Rai-Constapel, Vidisha, Liebermann, Heinz-Peter, Alekseyev, Aleksey B., Buenker, Robert J.

Journal:

Molecular Physics

Year:

2011

Language:

english

File:

PDF, 498 KB

english, 2011

6

On the numerical solution of the multidimensional vibrational time-independent Schroedinger equation

J.R. Alvarez-Collado, Robert J. Buenker

Journal:

Journal of Computational Chemistry

Year:

1992

Language:

english

File:

PDF, 663 KB

english, 1992

7

Calculation of the vertical electron attachment energy of carbon dioxide: Continuum states for negative ions

Pablo J. Bruna, Sigrid D. Peyerimhoff, Robert J. Buenker

Journal:

Chemical Physics Letters

Year:

1976

Language:

english

File:

PDF, 685 KB

english, 1976

8

Potential surfaces and vibronic coupling for the conical intersection of the Ã2A1 and B̃2B2 states of NH2

Carlo Petrongolo, Robert J. Buenker, Sigrid D. Peyerimhoff

Journal:

Chemical Physics Letters

Year:

1985

Language:

english

File:

PDF, 362 KB

english, 1985

9

Book reviews

W. H. E. Schwarz, Robert J. Buenker

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1985

Language:

english

File:

PDF, 115 KB

english, 1985

10

Ab initio MRD CI calculations for the electron spectrum of the C3 radical

Joachim Römelt, Sigrid D. Peyerimhoff, Robert J. Buenker

Journal:

Chemical Physics Letters

Year:

1978

Language:

english

File:

PDF, 738 KB

english, 1978

11

Stability and structure of the C 2 H 6+ ion: investigation of the photoelectron spectrum of ethane below 14 eV using ab initio methods

Richartz, Adolf, Buenker, Robert J., Bruna, Pablo J., Peyerimhoff, Sigrid D.

Journal:

Molecular Physics

Year:

1977

Language:

english

File:

PDF, 1.08 MB

english, 1977

12

Theoretical determination of the reaction path in the prototype electrocyclic transformation between cyclobutene and cis-butadiene. Thermochemical process

Buenker, Robert J., Hsu, Kang, Peyerimhoff, Sigrid D.

Journal:

Journal of the American Chemical Society

Year:

1971

Language:

english

File:

PDF, 1.36 MB

english, 1971

13

Ab initio configuration interaction calculations of the potential curves and lifetimes of the low-lying electronic states of the lead dimer

Das, Kalyan K., Liebermann, Heinz-Peter, Buenker, Robert J., Hirsch, Gerhard

Journal:

The Journal of Chemical Physics

Year:

1996

Language:

english

File:

PDF, 490 KB

english, 1996

14

Bending potentials for H2O in the ground and the first six singlet excited states

Giannoula Theodorakopoulos, Ioannis D. Petsalakis, Robert J. Buenker, Sigrid D. Peyerimhoff

Journal:

Chemical Physics Letters

Year:

1984

Language:

english

File:

PDF, 354 KB

english, 1984

15

Accurate small split-valence 3-21SP and 4-22SP basis sets for the first-row atoms

Alexander V. Mitin, Gerhard Hirsch, Robert J. Buenker

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 524 KB

english, 1996

16

The Ballik-Ramsay, Mulliken, Deslandres-d'Azambuja and Phillips systems in C2: a theoretical study of their electronic transition moments

Cary F. Chabalowski, Sigrid D. Peyerimhoff, Robert J. Buenker

Journal:

Chemical Physics

Year:

1983

Language:

english

File:

PDF, 1.19 MB

english, 1983

17

Theoretical study of the energies and lifetimes of the low-lying states of bismuth fluoride

Aleksey B. Alekseyev, Heinz-Peter Liebermann, Ihsan Boustani, Gerhard Hirsch, Robert J. Buenker

Journal:

Chemical Physics

Year:

1993

Language:

english

File:

PDF, 1.06 MB

english, 1993

18

Individualized configuration selection in CI calculations with subsequent energy extrapolation

Robert J. Buenker, Sigrid D. Peyerimhoff

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1974

Language:

english

File:

PDF, 1.55 MB

english, 1974

19

Configuration interaction study of the oscillator strenghts for the B1A1X1A1 and D1A1X1A1 transitions of the water molecule

Giannoula Theodorakopoulos, Ioannis D. Petsalakis, Cleanthes A. Nicolaides, Robert J. Buenker

Journal:

Chemical Physics

Year:

1985

Language:

english

File:

PDF, 719 KB

english, 1985

20

Individualized configuration selection in CI calculations with subsequent energy extrapolation

Robert J. Buenker, Sigrid D. Peyerimhoff

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1974

Language:

english

File:

PDF, 1.55 MB

english, 1974

21

Use of configuration selection methods to study the sudden polarization effect

Bonacic-Koutecky, Vlasta, Buenker, Robert J., Peyerimhoff, Sigrid D.

Journal:

Journal of the American Chemical Society

Year:

1979

Language:

english

File:

PDF, 746 KB

english, 1979

22

Scattering angle dependence of electron impact excitation: Intensity variation within a vibrational progression

Dillon, Michael, Kimura, Mineo, Buenker, Robert J., Hirsch, Gerhard, Li, Yan, Chantranupong, Lek

Journal:

The Journal of Chemical Physics

Year:

1995

Language:

english

File:

PDF, 505 KB

english, 1995

23

Geometry of Molecules. II. Diborane and Ethane

Buenker, Robert J.

Journal:

The Journal of Chemical Physics

Year:

1966

Language:

english

File:

PDF, 972 KB

english, 1966

24

collisions between 0.5 and

Suno, Hiroya, Rai, Sachchida N., Liebermann, Heinz-Peter, Buenker, Robert J., Kimura, Mineo, Janev, R. K.

Journal:

Physical Review A

Year:

2004

Language:

english

File:

PDF, 108 KB

english, 2004

25

regime

Suzuki, Reiko, Rai, Sachchida N., Liebermann, Heinz-Peter, Buenker, Robert J., Pichl, Lukáš, Kimura, Mineo

Journal:

Physical Review A

Year:

2005

Language:

english

File:

PDF, 412 KB

english, 2005

26

Complex self-consistent field and multireference single- and double-excitation configuration interaction calculations for the Πg2 resonance state of N2−

Honigmann, Michael, Buenker, Robert J., Liebermann, Heinz-Peter

Journal:

The Journal of Chemical Physics

Year:

2006

Language:

english

File:

PDF, 329 KB

english, 2006

27

Comment on “On the direct complex scaling of matrix elements expressed in a discrete variable representation: Application to molecular resonances” [J. Chem. Phys. 104 , 7008 (1996)]

Bludský, Ota, Li, Yan, Hirsch, Gerhard, Buenker, Robert J.

Journal:

The Journal of Chemical Physics

Year:

1998

Language:

english

File:

PDF, 311 KB

english, 1998

28

The influence of pseudo-states on the single-electron capture processes in low-energy collisions of N5+ with He

Wang, Kun, QU, Yizhi, Liu, Chunhua, Liu, Ling, Wu, Yong, Liebermann, Heinz-Peter, Buenker, Robert J

Journal:

Journal of Physics B Atomic Molecular and Optical Physics

Year:

2019

Language:

english

File:

PDF, 1.78 MB

english, 2019

29

Ab initio CI study of the stability and electronic spectrum of the HOCl molecule

Gerhard Hirsch, Pablo J. Bruna, Sigrid D. Peyerimhoff, Robert J. Buenker

Journal:

Chemical Physics Letters

Year:

1977

Language:

english

File:

PDF, 732 KB

english, 1977

30

A theoretical study of the bound electronic states of the C−2 negative ion

Monika Zeitz, Sigrid D. Peyerimhoff, Robert J. Buenker

Journal:

Chemical Physics Letters

Year:

1979

Language:

english

File:

PDF, 612 KB

english, 1979

31

Ab initio investigation of the vibronic structure in the C2H spectrum: Calculation of vibronic energies and wavefunctions for various isotopomers

Miljenko Perić, Sigrid D. Peyerimhoff, Robert J. Buenker

Journal:

Journal of Molecular Spectroscopy

Year:

1991

Language:

english

File:

PDF, 1.28 MB

english, 1991

32

Ab initio MRD-CI potential surfaces for the low-lying states of the NH+2 molecular ion

Sigrid D. Peyerimhoff, Robert J. Buenker

Journal:

Chemical Physics

Year:

1979

Language:

english

File:

PDF, 833 KB

english, 1979

33

Theoretical study of the core-ionized and various core-excited and shake-up states of acetylene and ethylene by ab initio MRD-CI methods

Andreas Barth, Robert J. Buenker, Sigrid D. Peyerimhoff, Werner Butscher

Journal:

Chemical Physics

Year:

1980

Language:

english

File:

PDF, 1.31 MB

english, 1980

34

MRD CI calculations on the asymmetric stretch potentials of H2O in the ground and the first seven singlet excited states

Giannoula Theodorakopoulos, Ioannis D. Petsalakis, Robert J. Buenker

Journal:

Chemical Physics

Year:

1985

Language:

english

File:

PDF, 931 KB

english, 1985

35

AB initio calculation of the zero-field splittings of the X3Σg− and B3Πg,i states of the S2 molecule

Bernd A. Hess, Robert J. Buenker, Christel M. Marian, Sigrid D. Peyerimhoff

Journal:

Chemical Physics

Year:

1982

Language:

english

File:

PDF, 573 KB

english, 1982

36

Ab initio CI study of the electronic spectrum of acetone

Bernd Hess, Pablo J. Bruna, Robert J. Buenker, Sigrid D. Peyerimhoff

Journal:

Chemical Physics

Year:

1976

Language:

english

File:

PDF, 917 KB

english, 1976

37

Ab initio MRD-CI study of the rydberg states of methylene

Joachim Römelt, Sigrid D. Peyerimhoff, Robert J. Buenker

Journal:

Chemical Physics

Year:

1981

Language:

english

File:

PDF, 898 KB

english, 1981

38

Theoretical study of cyclopropene and its C3H4isomers

Sigrid D. Peyerimhoff, Robert J. Buenker

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1969

Language:

english

File:

PDF, 803 KB

english, 1969

39

Fourfold clusters of rovibrational energies in H2Te studied with an ab initio potential energy function

Per Jensen, Yan Li, Gerhard Hirsch, Robert J. Buenker, Timothy J. Lee, Igor N. Kozin

Journal:

Chemical Physics

Year:

1995

Language:

english

File:

PDF, 749 KB

english, 1995

40

AsH3 ultraviolet photochemistry: An ab initio view

Alekseyev, Aleksey B., Buenker, Robert J., Liebermann, Heinz–Peter

Journal:

The Journal of Chemical Physics

Year:

2012

Language:

english

File:

PDF, 707 KB

english, 2012

41

Electronic structure of the SiP + radical on the basis of ab initio MRD-CI calculations

Dohmann, Helmut, Bruna, Pablo J., Peyerimhoff, Sigrid D., Buenker, Robert J.

Journal:

Molecular Physics

Year:

1984

Language:

english

File:

PDF, 1.46 MB

english, 1984

42

Electronic states and transitions of bismuth sulfide

Lingott, Rainer M., Liebermann, Heinz-Peter, Alekseyev, Aleksey B., Buenker, Robert J.

Journal:

The Journal of Chemical Physics

Year:

1999

Language:

english

File:

PDF, 398 KB

english, 1999

43

Charge transfer for the ground state O[sup +]([sup 4]S) ion in collisions with H[sub 2] molecules

Pichl, Lukáš, Li, Yan, Liebermann, Heinz-Peter, Buenker, Robert J., Kimura, Mineo

Journal:

The Journal of Chemical Physics

Year:

2003

Language:

english

File:

PDF, 436 KB

english, 2003

44

The electronic structure of HO 2+

Vazquez, Gabriel J., Buenker, Robert J., Peyerimhoff, Sigrid D.

Journal:

Molecular Physics

Year:

1986

Language:

english

File:

PDF, 1.51 MB

english, 1986

45

Ab initio calculations of the electronic states of AsH2 including dissociation characteristics

Alekseyev, Aleksey B., Buenker, Robert J., Liebermann, Heinz–Peter

Journal:

The Journal of Chemical Physics

Year:

2011

Language:

english

File:

PDF, 720 KB

english, 2011

46

Theoretical calculations on the linewidths of rovibrational levels of the 3d Rydberg states of BeH and BeD

Petsalakis, Ioannis D, Papadopoulos, Demetrios, Theodorakopoulos, Giannoula, Buenker, Robert J

Journal:

Journal of Physics B Atomic Molecular and Optical Physics

Year:

1999

Language:

english

File:

PDF, 170 KB

english, 1999

47

On the nature of the reaction path from the 2 B 2 stationary point to the [Xtilde] 2 A 1 minimum on the lowest 2 A′ potential energy surface of NO 2

Hirsch, Gerhard, Buenker, Robert J., Petrongolo, Carlo

Journal:

Molecular Physics

Year:

1992

Language:

english

File:

PDF, 432 KB

english, 1992

48

ChemInform Abstract: NICHTEMPIRISCHE BERECHNUNGEN DER RK.-FLAECHE DER ADDITION DES AMINORADIKALS AN AETHYLEN

SHIH, SHINGKUO, BUENKER, ROBERT J., PEYERIMHOFF, SIGRID D., MICHEJDA, CHRISTOPHER J.

Journal:

Chemischer Informationsdienst

Year:

1973

File:

PDF, 104 KB

1973

49

All-electron CI calculations for core-ionized, core-valence excited and shake-up states of N2

Werner Butscher, Robert J. Buenker, Sigrid D. Peyerimhoff

Journal:

Chemical Physics Letters

Year:

1977

Language:

english

File:

PDF, 902 KB

english, 1977

50

Ab initio study of the mixing of valence and Rydberg states in O2: CI potential curves for the3Σu−,3Δu and3Πu states

Robert J. Buenker, Sigrid D. Peyerimhoff

Journal:

Chemical Physics Letters

Year:

1975

Language:

english

File:

PDF, 691 KB

english, 1975

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