Volume 102; Issue 37

Journal of Physical Chemistry A

Volume 102; Issue 37

1

A Bond Path: A Universal Indicator of Bonded Interactions

Bader, R. F. W.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 139 KB

english, 1998

2

Toward Organic Superbases: The Electronic Structure and the Absolute Proton Affinity of Quinodiimines and Some Related Compounds

Maksić, Z. B., Kovačević, B.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 99 KB

english, 1998

3

van der Waals Complexes of Water with Oxygen and Nitrogen: Infrared Spectra and Atmospheric Implications

Svishchev, Igor M., Boyd, Russell J.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 28 KB

english, 1998

4

Master Equation and Molecular Dynamics Simulations of Excitability in a Model Chemical System

Nowakowski, B., Gorecki, J., Kawczyński, A. L.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 123 KB

english, 1998

5

Distributed-Gauge Calculations of Current Density Maps, Magnetizabilities, and Shieldings for a Series of Neutral and Dianionic Fused Tetracycles: Pyracylene (C 14 H 8 ), Acepleiadylene (C 16 H 10 ), and Dipleiadiene (C 18 H 12 )

Fowler, Patrick W., Steiner, Erich, Cadioli, Beniamino, Zanasi, Riccardo

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 111 KB

english, 1998

6

Methane Activation by Naked Rh + Atoms. A Theoretical Study

Westerberg, Joakim, Blomberg, Margareta R. A.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 61 KB

english, 1998

7

Molecular Crystal Structures and Nonlinear Optical Properties in the Series of Dicyanovinylbenzene and Its Derivatives

Antipin, Mikhail Yu., Timofeeva, Tatiana V., Clark, Ronald D., Nesterov, Vladimir N., Sanghadasa, Mohan, Barr, Thomas A., Penn, Benjamin, Romero, Leonard, Romero, Melvin

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 121 KB

english, 1998

8

Matrix Isolation Spectroscopic Study of the 1:1 Complexes of TiF 4 with NH 3 and (CH 3 ) 3 N

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 49 KB

english, 1998

9

Librational Control of Photochemical Reactions in Small Clusters

Jungwirth, Pavel, Žďánská, Petra, Schmidt, Burkhard

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 50 KB

english, 1998

10

Multiple Solutions of Coupled Cluster Equations: An Application to Molecular Auger Spectra

Mitra, A., Mahapatra, U. S., Majumder, D., Sinha, D.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 78 KB

english, 1998

11

CHF 2 Cl and CH 3 CF 2 Cl Detection by Coherent Anti-Stokes Raman Scattering and Photoacoustic Raman Spectroscopy

Melchior, A., Bar, I., Rosenwaks, S.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 51 KB

english, 1998

12

Vibrational Lifetime Shortening in a Hydrogen-Bonded Dimer Monitored by Transient Hole Burning in the Infrared

Laenen, R., Simeonidis, K.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 74 KB

english, 1998

13

Indole−H 2 O in the Gas Phase. Structures, Barriers to Internal Motion, and S 1 ← S 0 Transition Moment Orientation. Solvent Reorganization in the Electronically Excited State

Korter, Timothy M., Pratt, David W., Küpper, Jochen

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 84 KB

english, 1998

14

Kinetics and Mechanism of the Reaction between Thiosulfate and Chlorine Dioxide

Horváth, Attila K., Nagypál, István

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 84 KB

english, 1998

15

Ab Initio Calculations and Internal Rotor: Contribution for Thermodynamic Properties S ° 298 and C p ( T )'s (300 < T /K < 1500): Group Additivity for Fluoroethanes

Yamada, Takahiro, Lay, Tsan H., Bozzelli, Joseph W.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 245 KB

english, 1998

16

Density Functional Study on the Structures and Energies of the Ti 2 C 3 Cluster

Sumathi, Raman, Hendrickx, Marc

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 112 KB

english, 1998

17

Kinetics of NCl(a 1 Δ and b 1 Σ + ) Generation: The Cl + N 3 Rate Constant, the NCl(a 1 Δ) Product Branching Fraction, and Quenching of NCl(a 1 Δ) by F and Cl Atoms

Manke, G. C., Setser, D. W.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 176 KB

english, 1998

18

Electronic Band Systems of SF 2 Radicals Observed by Resonance-Enhanced Multiphoton Ionization

Li, Quanxin, Shu, Jinian, Zhang, Qun, Yu, Shuqin, Zhang, Limin, Chen, Congxiang, Ma, Xingxiao

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 106 KB

english, 1998

19

Manifestation of Chaotic Nuclear Dynamics of Highly Excited Polyatomic Molecules in Time-Resolved Electron Diffraction Data

Ischenko, A. A., Schäfer, L., Ewbank, J. D.

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 101 KB

english, 1998

20

Production of Vibrationally Excited CN(B 2 Σ + ) via Superexcited Ion-Pair State of Triatomic Alkali-Metal Cyanides by Ar( 3 P 2,0 ) Impact

Yasumatsu, Hisato, Suzuki, Kaoru, Kondow, Tamotsu

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 70 KB

english, 1998

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