Volume 103; Issue 2

Journal of Physical Chemistry A

Volume 103; Issue 2

1

The Lewis Model and Beyond

Fradera, Xavier, Austen, Maggie A., Bader, Richard F. W.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 100 KB

english, 1999

2

Calculation of Vibrational Spectra of Linear Tetrapyrroles. 1. Global Sets of Scaling Factors for Force Fields Derived by ab Initio and Density Functional Theory Methods

Magdó, Ildikó, Németh, Károly, Mark, Franz, Hildebrandt, Peter, Schaffner, Kurt

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 160 KB

english, 1999

3

Self-Recombination Rate Constants for 2-Propanol and tert -Butyl alcohol Radicals in Water †

Mezyk, Stephen P., Madden, Keith P.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 102 KB

english, 1999

4

A Topological Analysis of Electron Density in Cation−π Complexes

Cubero, E., Orozco, M., Luque, F. J.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 110 KB

english, 1999

5

Reactions of Boron Oxide and B n O m H + Cluster Ions with Water

Łapicki, Adam, Peiris, Dilrukshi M., Smolanoff, Jason N., Anderson, Scott L.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 142 KB

english, 1999

6

Theoretical Study of Strong Hydrogen Bonds between Neutral Molecules: The Case of Amine Oxides and Phosphine Oxides as Hydrogen Bond Acceptors

Alkorta, Ibon, Elguero, Jose

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 175 KB

english, 1999

7

1,4-Cyclohexanedione−Bromate−Acid Oscillatory System. IV. Reduced Models

Szalai, István, Körös, Endre, Györgyi, László

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 78 KB

english, 1999

8

Far-Infrared Studies on the Intermolecular Dynamics of Systems Containing Water. The Influence of Ionic Interactions in NaCl, LiCl, and HCl Solutions

Zoidis, Evangelos, Yarwood, Jack, Besnard, Marcel

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 299 KB

english, 1999

9

A G2 Study on CH Insertions into PH 3 , H 2 S, and HCl

Wang, Zhi-Xiang, Huang, Ming-Bao

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 93 KB

english, 1999

10

Fe−Catecholate and Fe−Oxalate Vibrations and Isotopic Substitution Shifts from DFT Quantum Chemistry

Öhrström, Lars, Michaud-Soret, Isabelle

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 133 KB

english, 1999

11

First Observation of the Excited Doublet State of a Radical−Triplet Pair in Solution: W-Band High-Field Time-Resolved Electron Paramagnetic Resonance Spectroscopy

Fujisawa, Jun-ichi, Ishii, Kazuyuki, Ohba, Yasunori, Yamauchi, Seigo, Fuhs, Michael, Möbius, Klaus

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 89 KB

english, 1999

12

Kinetic Studies on the N( 2 D, 2 P) + CH 4 and CD 4 Reactions: The Role of Nonadiabatic Transitions on Thermal Rate Constants

Takayanagi, Toshiyuki, Kurosaki, Yuzuru, Sato, Kei, Misawa, Kazuaki, Kobayashi, Yasuhide, Tsunashima, Shigeru

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 85 KB

english, 1999

13

Phototautomeric Reaction, Tautomerism, and Infrared Spectra of 6-Thiopurine. Experimental Matrix Isolation and Quantum-Mechanical (Conventional ab Initio and Density-Functional Theory) Studies

Lapiński, Leszek, Nowak, Maciej J., Kwiatkowski, Józef S., Leszczynski, Jerzy

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 112 KB

english, 1999

14

Photolysis of Disilane at 193 nm

Tada, Naoya, Tonokura, Kenichi, Matsumoto, Keiji, Koshi, Mitsuo, Miyoshi, Akira, Matsui, Hiroyuki

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 153 KB

english, 1999

15

Ring-Opening Reaction of Cyclobutene Radical Cation: Effect of Solvent on Competing Pathways

Barone, Vincenzo, Rega, Nadia, Bally, Thomas, Sastry, G. Narahari

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 60 KB

english, 1999

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