Volume 273; Issue 5-6

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Chemical Physics Letters
Volume 273; Issue 5-6

Chemical Physics Letters

Volume 273; Issue 5-6

1

Fixed-sample optimization in quantum Monte Carlo using a probability density function

R.N. Barnett, Zhiwei Sun, W.A. Lester Jr.

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 548 KB

english, 1997

2

Geometry, electronic structure and magnetism of small Con (n = 2−8) clusters

Hong-Jun Fan, Chun-Wan Liu, Meng-Sheng Liao

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 523 KB

english, 1997

3

Ab initio MO studies of Si4NO+ clusters

Wen-Ning Wang, Kang-Nian Fan, Suehiro Iwata

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 455 KB

english, 1997

4

A high-order and broadband CRAMPS experiment using z-rotational decoupling

M. Hohwy, P.V. Bower, H.J. Jakobsen, N.C. Nielsen

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 465 KB

english, 1997

5

Solvation of charge in aromatic/noble gas Van der Waals clusters

Stéphane Douin, Susanna Piccirillo, Philippe Bréchignac

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 587 KB

english, 1997

6

The investigation of donor and acceptor states in nanoparticles of the layered semiconductor PbI2

E. Lifshitz, L. Bykov, M. Yassen, Z. Chen-Esterlit

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 656 KB

english, 1997

7

Experimentally realizable insight into the dynamics of chiral molecules

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 778 KB

english, 1997

8

Three-photon upconversion in Er3+ doped Ca3Al2Ge3O12

Xiao Zhang, Jianhui Yuan, Xingren Liu, Jean Pierre Jouart, Gérard Mary

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 297 KB

english, 1997

9

Partition function and the level density of the hindered rotor

W. Witschel, C. Hartwigsen

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 443 KB

english, 1997

10

Covalent contributions to bonding in group 12 dimers M2 (Mn = Zn, Cd, Hg)

Ming Yu, Michael Dolg

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 607 KB

english, 1997

11

Basic steps involved in the lateral manipulation of single CO molecules and rows of CO molecules

L. Bartels, G. Meyer, K.-H. Rieder

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 343 KB

english, 1997

12

RBS analysis of Langmuir-Blodgett films bearing quantum-sized CdS particles

Tetsuya Yamaki, Keisuke Asai, Kenkichi Ishigure

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 421 KB

english, 1997

13

Mass analyzed threshold ionization of chlorobenzene and chlorobenzene · Ar1

Gerhard Lembach, Bernhard Brutschy

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 576 KB

english, 1997

14

Contracted or uncontracted polarization functions? Comment on Dunning's correlation-consistent basis sets

Tomohiro Hashimoto, Kimihiko Hirao, Hiroshi Tatewaki

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 475 KB

english, 1997

15

Raman intensities and molecular hyperpolarizability of polyindenofluorene

Mariacristina Rumi, Giuseppe Zerbi, Ullrich Scherf, Helge Reisch

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 374 KB

english, 1997

16

A novel representation in the CIDEP theory

A.A. Neufeld, P.A. Purtov, A.B. Doktorov

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 520 KB

english, 1997

17

Thermal road for fullerene annealing

P.A. Marcos, M.J. López, A. Rubio, J.A. Alonso

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 286 KB

english, 1997

18

Heat capacity and crystal polymorph of the organic charge-transfer complex, tetrathiafulvalene-p-chloranil

Tomoko Kawamura, Yuji Miyazaki, Michio Sorai

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 313 KB

english, 1997

19

Ab initio molecular dynamics of ion solvation. The case of Be2+ in water

Dominik Marx, Michiel Sprik, Michele Parrinello

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 531 KB

english, 1997

20

Emission properties of 1,4-anthraquinone

Takao Itoh, Minoru Yamaji, Haruo Shizuka

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 297 KB

english, 1997

21

Single molecules observed by immersion mirror objective. A novel method of finding the orientation of a radiating dipole

Jan Jasny, Jerzy Sepioł

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 321 KB

english, 1997

22

Single molecules observed by immersion mirror objective. The orientation of terrylene molecules via the direction of its transition dipole moment

Jerzy Sepioł, Jan Jasny, Jürg Keller, Urs P. Wild

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 369 KB

english, 1997

23

Temperature effect on the ionization potential line-shape of NO doped into dense gaseous argon

A.K. Al-Omari, R. Reininger, D.L. Huber

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 358 KB

english, 1997

24

Author index to volume 273

Journal:

Chemical Physics Letters

Année:

1997

Langue:

english

Fichier:

PDF, 360 KB

english, 1997