Works matching IS 00207608 AND DT 1999 AND VI 72 AND IP 4

Results: 29

Optogalvanism in a neon plasma.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 369, doi. 10.1002/(SICI)1097-461X(1999)72:4<369::AID-QUA21>3.0.CO;2-#

By:

Yao, Xuan;
McGlynn, Sean P.

Publication type:

Article

PhD students and post-doctoral fellows of Lionel Goodman.

Published in:: International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 245, doi. 10.1002/(SICI)1097-461X(1999)72:4<245::AID-QUA5>3.0.CO;2-Y
Publication type:: Article

An ab initio study of the structures and properties of the XH.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 319, doi. 10.1002/(SICI)1097-461X(1999)72:4<319::AID-QUA14>3.0.CO;2-6

By:

Babinec, Peter;
Leszczynski, Jerzy

Publication type:

Article

Two-dimensional treatment of the aldehydic carbonyl torsion and hydrogen wagging in gas-phase propanal.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 411, doi. 10.1002/(SICI)1097-461X(1999)72:4<411::AID-QUA25>3.0.CO;2-9

By:

Vivier-Bunge, A.;
Uc, V. H.;
Smeyers, Y. G.

Publication type:

Article

Natural steric analysis of internal rotation barriers.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 269, doi. 10.1002/(SICI)1097-461X(1999)72:4<269::AID-QUA9>3.0.CO;2-8

By:

Badenhoop, J. K.;
Weinhold, F.

Publication type:

Article

Vibrational assignments for indole with the aid of ultrasharp phosphorescence spectra.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 347, doi. 10.1002/(SICI)1097-461X(1999)72:4<347::AID-QUA18>3.0.CO;2-O

By:

Fender, Bruce J.;
Short, Kurt W.;
Hahn, David K.;
Callis, Patrik R.

Publication type:

Article

Influence of substituents and chain length on the optical properties of poly( p-phenylenevinylene) oligomers.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 463, doi. 10.1002/(SICI)1097-461X(1999)72:4<463::AID-QUA29>3.0.CO;2-H

By:

Davis, William B.;
Wasielewski, Michael R.;
Ratner, Mark A.

Publication type:

Article

Quantum confinement induced collapse of a large to a small radius self-trapped exciton in a permethylated polysilane chain.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 361, doi. 10.1002/(SICI)1097-461X(1999)72:4<361::AID-QUA20>3.0.CO;2-A

By:

Raymond, Mary K.;
Michl, Josef

Publication type:

Article

Lionel Goodman-publications.

Published in:: International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 241, doi. 10.1002/(SICI)1097-461X(1999)72:4<241::AID-QUA4>3.0.CO;2-C
Publication type:: Article

Ab initio molecular orbital and density functional study of the C6H6⋅I2 complex in the ground and excited electronic states.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 307, doi. 10.1002/(SICI)1097-461X(1999)72:4<307::AID-QUA13>3.0.CO;2-E

By:

Mebel, A. M.;
Lin, H. L.;
Lin, S. H.

Publication type:

Article

Density functional theory of CH bond activation by transition-metal complex: A (η5-C5H5)ML (M=Rh, Ir; L=CH2, CO, SH2, PH3)+CH4 case study.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 405, doi. 10.1002/(SICI)1097-461X(1999)72:4<405::AID-QUA24>3.0.CO;2-B

By:

Su, Ming-Der;
Chu, San-Yan

Publication type:

Article

High-frequency Floquet theory: Test of the applicability of the golden rule.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 261, doi. 10.1002/(SICI)1097-461X(1999)72:4<261::AID-QUA8>3.0.CO;2-Z

By:

Lefebvre, R.

Publication type:

Article

Searching for the conformers of n-butylbenzene.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 341, doi. 10.1002/(SICI)1097-461X(1999)72:4<341::AID-QUA17>3.0.CO;2-X

By:

Philis, John G.;
Kosmidis, Constantine

Publication type:

Article

Effect of vibrational coherence on rotational dynamics in solution.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 451, doi. 10.1002/(SICI)1097-461X(1999)72:4<451::AID-QUA28>3.0.CO;2-P

By:

Gnanakaran, S.;
Hochstrasser, R. M.

Publication type:

Article

Biographical sketch-Lionel Goodman.

Published in:: International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 239, doi. 10.1002/(SICI)1097-461X(1999)72:4<239::AID-QUA3>3.0.CO;2-T
Publication type:: Article

Interconversions of Z-1,3,5-hexatriene conformers: A theoretical study.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 295, doi. 10.1002/(SICI)1097-461X(1999)72:4<295::AID-QUA12>3.0.CO;2-U

By:

Henseler, Debora;
Rebentisch, Rupert;
Hohlneicher, Georg

Publication type:

Article

Definition of eigenproblems suited to intermolecular perturbation theory.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 393, doi. 10.1002/(SICI)1097-461X(1999)72:4<393::AID-QUA23>3.0.CO;2-R

By:

Adams, William H.

Publication type:

Article

Scaled quantum mechanical study of vibrational force field for p-difluorobenzene and p-fluorotoluene.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 249, doi. 10.1002/(SICI)1097-461X(1999)72:4<249::AID-QUA7>3.0.CO;2-G

By:

Jarzęcki, Andrzej A.;
Davidson, Ernest R.;
Ju, Quan;
Parmenter, Charles S.

Publication type:

Article

Systematic analysis of substituent effects. II. Charges and energies of atoms in fluorochloroethanes.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 331, doi. 10.1002/(SICI)1097-461X(1999)72:4<331::AID-QUA16>3.0.CO;2-2

By:

Cioslowski, Jerzy;
Varnali, Tereza

Publication type:

Article

Effect of different capping environments on the optical properties of CdS nanoparticles in reverse micelles.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 439, doi. 10.1002/(SICI)1097-461X(1999)72:4<439::AID-QUA27>3.0.CO;2-Q

By:

Zou, B. S.;
Little, R. B.;
Wang, J. P.;
El-Sayed, M. A.

Publication type:

Article

Introduction: Lionel Goodman's research career.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 237, doi. 10.1002/(SICI)1097-461X(1999)72:4<237::AID-QUA2>3.0.CO;2-1

By:

Kasha, Michael

Publication type:

Article

Pressure-induced phase transitions of 1,2,4,5-tetrafluorobenzene crystal.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 287, doi. 10.1002/(SICI)1097-461X(1999)72:4<287::AID-QUA11>3.0.CO;2-Y

By:

Mizobe, Hideki;
Shimada, Hiroko;
Shimada, Ryoichi

Publication type:

Article

Connection between semi-empirical and ab initio methods in the quantum theory of molecular electronic spectra.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 379, doi. 10.1002/(SICI)1097-461X(1999)72:4<379::AID-QUA22>3.0.CO;2-U

By:

Löwdin, Per-Olov

Publication type:

Article

List of participants.

Published in:: International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 247, doi. 10.1002/(SICI)1097-461X(1999)72:4<247::AID-QUA6>3.0.CO;2-P
Publication type:: Article

The freeon theory of molecular magnets. III. The linear polyene model.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 325, doi. 10.1002/(SICI)1097-461X(1999)72:4<325::AID-QUA15>3.0.CO;2-4

By:

Matsen, F. A.

Publication type:

Article

Solvatochromism of fluorophores with an intramolecular hydrogen bond and their use as probes in biomolecular cavity sites.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 421, doi. 10.1002/(SICI)1097-461X(1999)72:4<421::AID-QUA26>3.0.CO;2-3

By:

Catalán, Javier;
Del Valle, Juan Carlos;
Díaz, Cristina;
Palomar, Jose;
De Paz, Jose L. G.;
Kasha, Michael

Publication type:

Article

Quantum theory of thermal fluctuations in DNA miniplasmids.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 357, doi. 10.1002/(SICI)1097-461X(1999)72:4<357::AID-QUA19>3.0.CO;2-I

By:

Tobias, Irwin

Publication type:

Article

Photo of Lionel Goodman.

Published in:: International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 235, doi. 10.1002/(SICI)1097-461X(1999)72:4<235::AID-QUA1>3.0.CO;2-A
Publication type:: Article

Views of a molecule by chemists and physicists.

Published in:

International Journal of Quantum Chemistry, 1999, v. 72, n. 4, p. 281, doi. 10.1002/(SICI)1097-461X(1999)72:4<281::AID-QUA10>3.0.CO;2-6

By:

Monkhorst, Hendrik J.

Publication type:

Article

Works matching IS 00207608 AND DT 1999 AND VI 72 AND IP 4

Optogalvanism in a neon plasma.

PhD students and post-doctoral fellows of Lionel Goodman.

An ab initio study of the structures and properties of the XH.

Two-dimensional treatment of the aldehydic carbonyl torsion and hydrogen wagging in gas-phase propanal.

Natural steric analysis of internal rotation barriers.

Vibrational assignments for indole with the aid of ultrasharp phosphorescence spectra.

Influence of substituents and chain length on the optical properties of poly( p-phenylenevinylene) oligomers.

Quantum confinement induced collapse of a large to a small radius self-trapped exciton in a permethylated polysilane chain.

Lionel Goodman-publications.

Ab initio molecular orbital and density functional study of the C<sub>6</sub>H<sub>6</sub>⋅I<sub>2</sub> complex in the ground and excited electronic states.

Density functional theory of CH bond activation by transition-metal complex: A (η<sup>5</sup>-C<sub>5</sub>H<sub>5</sub>)ML (M=Rh, Ir; L=CH<sub>2</sub>, CO, SH<sub>2</sub>, PH<sub>3</sub>)+CH<sub>4</sub> case study.

High-frequency Floquet theory: Test of the applicability of the golden rule.

Searching for the conformers of n-butylbenzene.

Effect of vibrational coherence on rotational dynamics in solution.

Biographical sketch-Lionel Goodman.

Interconversions of Z-1,3,5-hexatriene conformers: A theoretical study.

Definition of eigenproblems suited to intermolecular perturbation theory.

Scaled quantum mechanical study of vibrational force field for p-difluorobenzene and p-fluorotoluene.

Systematic analysis of substituent effects. II. Charges and energies of atoms in fluorochloroethanes.

Effect of different capping environments on the optical properties of CdS nanoparticles in reverse micelles.

Introduction: Lionel Goodman's research career.

Pressure-induced phase transitions of 1,2,4,5-tetrafluorobenzene crystal.

Connection between semi-empirical and ab initio methods in the quantum theory of molecular electronic spectra.

List of participants.

The freeon theory of molecular magnets. III. The linear polyene model.

Solvatochromism of fluorophores with an intramolecular hydrogen bond and their use as probes in biomolecular cavity sites.

Quantum theory of thermal fluctuations in DNA miniplasmids.

Photo of Lionel Goodman.

Views of a molecule by chemists and physicists.