Volume 304; Issue 1-2

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Chemical Physics
Volume 304; Issue 1-2

Chemical Physics

Volume 304; Issue 1-2

1

Time-dependent variational approach to molecules in strong laser fields

Thomas Kreibich, Robert van Leeuwen, E.K.U. Gross

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 430 KB

english, 2004

2

Quantum mechanical study of electronic and nuclear dynamics of molecules in intense laser fields

Hirohiko Kono, Yukio Sato, Nobuyuki Tanaka, Tsuyoshi Kato, Katsunori Nakai, Shiro Koseki, Yuichi Fujimura

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 833 KB

english, 2004

3

Excited state direct dynamics of benzene with reparameterized multi-reference semiempirical configuration interaction methods

A Toniolo, Alexis L Thompson, Todd J Martı́nez

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 607 KB

english, 2004

4

Multi-mode–multi-state quantum dynamics of key five-membered heterocycles: spectroscopy and ultrafast internal conversion

H. Köppel, E.V. Gromov, A.B. Trofimov

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 487 KB

english, 2004

5

Multimode Jahn–Teller and pseudo-Jahn–Teller coupling effects in the photoelectron spectrum of CH3F

S. Mahapatra, V. Vallet, C. Woywod, H. Köppel, W. Domcke

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 508 KB

english, 2004

6

Preface

O Kühn, J Manz, W.H Miller

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 134 KB

english, 2004

7

Intramolecular vibrational energy redistribution in toluene: a nine-dimensional quantum mechanical study using the MCTDH algorithm

Fabien Gatti, Hans-Dieter Meyer

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 417 KB

english, 2004

8

Semiclassical simulation of absorption spectra for a chromophore coupled to an anharmonic bath

Haobin Wang, Michael Thoss

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 362 KB

english, 2004

9

Theoretical study of ultrafast heterogeneous electron transfer reactions at dye–semiconductor interfaces

Michael Thoss, Ivan Kondov, Haobin Wang

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 762 KB

english, 2004

10

Application of the nuclear–electronic orbital method to hydrogen transfer systems: multiple centers and multiconfigurational wavefunctions

Michael V Pak, Chet Swalina, Simon P Webb, Sharon Hammes-Schiffer

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 250 KB

english, 2004

11

Ultrafast wave packet dynamics of an intramolecular hydrogen transfer system: from vibrational motion to reaction control

M Petković, O Kühn

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 1.08 MB

english, 2004

12

Performance and application of a symmetry adapted pseudo spectral method for scattering of a diatomic molecule from a square surface: H2 + Cu(1 0 0)

M.F. Somers, D. Lemoine, G.J. Kroes

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 393 KB

english, 2004

13

Massively parallel Hamiltonian action in pseudospectral algorithms applied to quantum dynamics of laser induced desorption

S Borowski, T Klüner

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 246 KB

english, 2004

14

The phase space CCS approach to quantum and semiclassical molecular dynamics for high-dimensional systems

Dmitrii V Shalashilin, Mark S Child

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 416 KB

english, 2004

15

Forward–backward semiclassical dynamics for systems of indistinguishable particles

Akira Nakayama, Nancy Makri

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 559 KB

english, 2004

16

A hybrid quantum/classical correlation function approach to surface diffusion

Toshiaki Taniike, Koichi Yamashita

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 536 KB

english, 2004

17

Multi-arrangement quantum dynamics in 6D: cis–trans isomerization and 1,3-hydrogen transfer in HONO

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 546 KB

english, 2004

18

Editorial board

Journal:

Chemical Physics

Year:

2004

Language:

english

File:

PDF, 67 KB

english, 2004