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1

Rotational rainbows in high energy H+CO scattering

Bela Gazdy, Joel M. Bowman, Qiyan Sun

Journal:

Chemical Physics Letters

Year:

1988

Language:

english

File:

PDF, 378 KB

english, 1988

2

Calculations of highly excited vibrational energies of HCN (n1, 0, n3): a test of a two-mode model, and comparison with experiment

Bela Gazdy, Joel M. Bowman

Journal:

Chemical Physics Letters

Year:

1990

Language:

english

File:

PDF, 597 KB

english, 1990

3

Variational calculations of bound and quasi-bound states of HCO (J=0 and 1) and comparison with experiment

Joel M. Bowman, Bela Gazdy

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 532 KB

english, 1992

4

A global ab initio potential for HCN/HNC, exact vibrational energies, and comparison for experiment

Joseph A. Bentley, Joel M. Bowman, Bela Gazdy, Timothy J. Lee, Christopher E. Dateo

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 608 KB

english, 1992

5

Coupled-channel scattering calculations of rotational resonances of ArHO(2Σ+, v=0)

Baiyu Pan, Joel M. Bowman, Bela Gazdy

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 284 KB

english, 1994

6

Variationally improved transition amplitudes from time-dependent Hartree–Fock wave functions: Application to He + He2+ collisions

Bela Gazdy, David A. Micha

Journal:

International Journal of Quantum Chemistry

Year:

1986

Language:

english

File:

PDF, 400 KB

english, 1986

7

A truncation/recoupling method for eigenvalues and eigenvectors ideal for parallel computation

Joel M. Bowman, Bela Gazdy

Journal:

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

Year:

1991

Language:

english

File:

PDF, 481 KB

english, 1991

8

Time dependence of OH overtone relaxation in the hydroperoxyl radical

Chapman, Douglas, Bowman, Joel M., Gazdy, Bela

Journal:

The Journal of Chemical Physics

Year:

1992

Language:

english

File:

PDF, 997 KB

english, 1992

9

A reduced dimensional L2 simulation of the photodetachment spectra of ClHCl- and IHI-

Bowman, Joel M., Gazdy, Bela

Journal:

Journal of Physical Chemistry

Year:

1989

Language:

english

File:

PDF, 835 KB

english, 1989

10

A New Perspective on Isomerization Dynamics Illustrated by HCN → HNC

Bowman, Joel M., Gazdy, Bela

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 112 KB

english, 1997

11

A comparison of scattering and L 2 photodetachment Franck?Condon factors for reduced dimensionality ClHCl?? Cl + HCl + e?

Bowman, Joel M., Gazdy, Bela, Sun, Qiyan

Journal:

Journal of the Chemical Society Faraday Transactions

Year:

1990

Language:

english

File:

PDF, 454 KB

english, 1990

12

Evidence for a rotational rainbow in inelastic hot atom experiments?

Bowman, Joel M., Gazdy, Bela

Journal:

The Journal of Chemical Physics

Year:

1987

Language:

english

File:

PDF, 305 KB

english, 1987

13

Classical energy transfer in forced oscillator models of inelastic scattering

Gazdy, Bela, Sun, Qiyan, Bowman, Joel M.

Journal:

The Journal of Chemical Physics

Year:

1987

Language:

english

File:

PDF, 592 KB

english, 1987

14

A three-dimensional L2 simulation of the photodetachment spectra of CIHCI− and IHI−

Gazdy, Bela, Bowman, Joel M.

Journal:

The Journal of Chemical Physics

Year:

1989

Language:

english

File:

PDF, 922 KB

english, 1989

15

A movable basis method to calculate vibrational energies of molecules

Bowman, Joel M., Gazdy, Bela

Journal:

The Journal of Chemical Physics

Year:

1990

Language:

english

File:

PDF, 1.03 MB

english, 1990

16

Theoretical stabilization and scattering studies of resonances in the addition reaction H+CO = HCO

Gazdy, Bela, Bowman, Joel M., Cho, Seon-Woog, Wagner, Albert F.

Journal:

The Journal of Chemical Physics

Year:

1991

Language:

english

File:

PDF, 494 KB

english, 1991

17

Isolated resonance decomposition of a multichannel S matrix: A test from the scattering of H+CO=HCO

Cho, Seon-Woog, Wagner, Albert F., Gazdy, Bela, Bowman, Joel M.

Journal:

The Journal of Chemical Physics

Year:

1992

Language:

english

File:

PDF, 772 KB

english, 1992

18

Novel decomposition of the multichannel scattering matrix at resonances

Gazdy, Bela, Bowman, Joel M.

Journal:

Physical Review Letters

Year:

1987

Language:

english

File:

PDF, 412 KB

english, 1987

19

The linearly driven parametric oscillator: Application to collisional energy transfera)

Gazdy, Bela, Micha, David A.

Journal:

The Journal of Chemical Physics

Year:

1985

Language:

english

File:

PDF, 964 KB

english, 1985

20

A simple method to adjust potential energy surfaces: Application to HCO

Bowman, Joel M., Gazdy, Bela

Journal:

The Journal of Chemical Physics

Year:

1991

Language:

english

File:

PDF, 332 KB

english, 1991

21

Electron transfer and spin-flip processes in atom-atom collisions from variationally improved time-dependent Hartree-Fock results

Gazdy, Bela, Micha, David A.

Journal:

Physical Review A

Year:

1987

Language:

english

File:

PDF, 605 KB

english, 1987

22

The linearly driven parametric oscillator: Its collisional time-correlation functiona)

Gazdy, Bela, Micha, David A.

Journal:

The Journal of Chemical Physics

Year:

1985

Language:

english

File:

PDF, 622 KB

english, 1985

23

Phase-invariant variational methods for transition amplitudes of atomic collisions

Micha, David A., Gazdy, Bela

Journal:

Physical Review A

Year:

1987

Language:

english

File:

PDF, 315 KB

english, 1987

24

New decomposition of the S matrix for multichannel resonant collisions

Gazdy, Bela, Bowman, Joel M.

Journal:

Physical Review A

Year:

1987

Language:

english

File:

PDF, 363 KB

english, 1987

25

Variational functional for transition amplitudes: Improving the time-dependent Hartree-Fock method

Gazdy, Bela, Micha, David A.

Journal:

Physical Review A

Year:

1986

Language:

english

File:

PDF, 208 KB

english, 1986

26

Molecular handedness and chiral strength determined by matter-wave circular dichroism

Garay, A. S., Ahlgren-Beckendorf, J. A., Gazdy, Bela

Journal:

Physical Review A

Year:

1993

Language:

english

File:

PDF, 222 KB

english, 1993

27

A truncation/recoupling method for basis set calculations of eigenvalues and eigenvectors

Bowman, Joel M., Gazdy, Bela

Journal:

The Journal of Chemical Physics

Year:

1991

Language:

english

File:

PDF, 775 KB

english, 1991

28

A method to constrain vibrational energy in quasiclassical trajectory calculations

Bowman, Joel M., Gazdy, Bela, Sun, Qiyan

Journal:

The Journal of Chemical Physics

Year:

1989

Language:

english

File:

PDF, 587 KB

english, 1989

29

An adjusted global potential surface for HCN based on rigorous vibrational calculations

Gazdy, Bela, Bowman, Joel M.

Journal:

The Journal of Chemical Physics

Year:

1991

Language:

english

File:

PDF, 852 KB

english, 1991

30

Application of adiabatic switching to vibrational energies of three-dimensional HCO, H2O, and H2CO

Sun, Qiyan, Bowman, Joel M., Gazdy, Bela

Journal:

The Journal of Chemical Physics

Year:

1988

Language:

english

File:

PDF, 733 KB

english, 1988

31

Theoretical studies of the reactivity and spectroscopy of H+CO=HCO. I. Stabilization and scattering studies of resonances for J=0 on the Harding ab initio surface

Cho, Seon-Woog, Wagner, Albert F., Gazdy, Bela, Bowman, Joel M.

Journal:

The Journal of Chemical Physics

Year:

1992

Language:

english

File:

PDF, 1.35 MB

english, 1992

32

Ab initio calculation of a global potential, vibrational energies, and wave functions for HCN/HNC, and a simulation of the Ã–X̃ emission spectrum

Bowman, Joel M., Gazdy, Bela, Bentley, Joseph A., Lee, Timothy J., Dateo, Christopher E.

Journal:

The Journal of Chemical Physics

Year:

1993

Language:

english

File:

PDF, 1.37 MB

english, 1993

33

Accurate quartic force fields and vibrational frequencies for hydrogen cyanide and hydrogen isocyanide

Lee, Timothy J., Dateo, Christopher E., Gazdy, Bela, Bowman, Joel M.

Journal:

Journal of Physical Chemistry

Year:

1993

Language:

english

File:

PDF, 871 KB

english, 1993

34

A potential surface for argon-hydroxyl(2.SIGMA.) and argon-hydroxyl-d(2.SIGMA.): fitting and assigning experimental data with rigorous theory

Bowman, Joel M., Gazdy, Bela., Schafer, Pamela., Heaven, Michael C.

Journal:

Journal of Physical Chemistry

Year:

1990

Language:

english

File:

PDF, 471 KB

english, 1990

35

A potential surface for argon-hydroxyl (2.SIGMA.) and argon-hydroxyl-(2.SIGMA.): fitting and assigning experimental data with rigorous theory [Erratum to document cited in CA112(16):148220y]

Bowman, Joel M., Gazdy, Bela., Schafer, Pamela., Heaven, Michael C.

Journal:

Journal of Physical Chemistry

Year:

1990

Language:

english

File:

PDF, 47 KB

english, 1990

36

The addition and dissociation reaction hydrogen atom + carbon monoxide .dblharw. formyl. 3. Implementation of isolated resonance RRKM theory with exact quantum studies for J = 0

Cho, Seon Woog, Wagner, Albert F., Gazdy, Bela, Bowman, Joel M.

Journal:

Journal of Physical Chemistry

Year:

1991

Language:

english

File:

PDF, 526 KB

english, 1991