Volume 103; Issue 21

Journal of Physical Chemistry A

Volume 103; Issue 21

1

Spectroscopy of Hydrothermal Reactions 13. Kinetics and Mechanisms of Decarboxylation of Acetic Acid Derivatives at 100−260 °C under 275 bar

Belsky, A. J., Maiella, P. G., Brill, T. B.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 116 KB

english, 1999

2

Oxidative Aromatic Substitutions: Hartree−Fock/Density Functional and ab Initio Molecular Orbital Studies of Benzene and Toluene Nitrosation 1

Skokov, Sergei, Wheeler, Ralph A.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 139 KB

english, 1999

3

Equilibrium Partial Pressures, Thermodynamic Properties of Aqueous and Solid Phases, and Cl 2 Production from Aqueous HCl and HNO 3 and Their Mixtures

Massucci, Mario, Clegg, Simon L., Brimblecombe, Peter

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 372 KB

english, 1999

4

Photoinduced Coupled Proton and Electron Transfers. 2. 7-Hydroxyquinolinium Ion

Bardez, Elisabeth, Fedorov, Aleksandre, Berberan-Santos, Mário Nuno, Martinho, José M. G.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 72 KB

english, 1999

5

18 O-Selective Infrared Multiple Photon Decomposition of Natural and 18 O-Enriched Diisopropyl Ethers

Sugita, Kyoko, Majima, Tetsuro, Arai, Shigeyoshi

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 79 KB

english, 1999

6

Solvation of Cu 2+ in Liquid Ammonia: Monte Carlo Simulation Including Three-Body Corrections

Pranowo, Harno D., Rode, Bernd M.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 132 KB

english, 1999

7

Four-Electron Three-Center Bonding: One-Electron and Concerted Two-Electron Delocalizations into Bonding and Antibonding Molecular Orbitals

Harcourt, Richard D.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 66 KB

english, 1999

8

Rate Coefficients for the Propargyl Radical Self-Reaction and Oxygen Addition Reaction Measured Using Ultraviolet Cavity Ring-down Spectroscopy

Atkinson, Dean B., Hudgens, Jeffrey W.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 116 KB

english, 1999

9

Molecular Activation by Surface Coordination: New Model for HCl Reactivity on Water−Ice Polar Stratospheric Clouds

MacTaylor, R. S., Gilligan, J. J., Moody, D. J., Castleman, A. W.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 64 KB

english, 1999

10

Stepwise versus Concerted Electron Transfer-Bond Fragmentation in the Reduction of Phenyl Triphenylmethyl Sulfides

Jakobsen, Steen, Jensen, Henrik, Pedersen, Steen U., Daasbjerg, Kim

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 39 KB

english, 1999

11

Isomerism of the Covalent Anion of the Uracil−Thymine Dimer. Ab Initio Study

Smith, Dayle M. A., Smets, Johan, Adamowicz, Ludwik

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 61 KB

english, 1999

12

Reaction of Aqueous 2-( N -Methylamino)ethanol Solutions with Carbon Dioxide. Chemical Species and Their Conformations Studied by Vibrational Spectroscopy and ab Initio Theories

Ohno, Keiichi, Inoue, Yutaka, Yoshida, Hiroshi, Matsuura, Hiroatsu

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 110 KB

english, 1999

13

Solvation of Sodium Chloride: An Effective Fragment Study of NaCl(H 2 O) n

Petersen, Christian P., Gordon, Mark S.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 110 KB

english, 1999

14

Atmospheric Degradation Mechanism of CF 3 OCH 3

Christensen, L. K., Wallington, T. J., Guschin, A., Hurley, M. D.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 95 KB

english, 1999

15

Enrichment of Silicon Isotopes with Infrared Free-Electron Laser Radiation

Lyman, John L., Newnam, Brian E., Noda, Tetsuji, Suzuki, Hiroshi

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 75 KB

english, 1999

16

Accurate Heats of Formation for BF n , BF n + , BCl n , and BCl n + for n = 1−3

Bauschlicher, Charles W., Ricca, Alessandra

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 49 KB

english, 1999

17

Photodissociation Dynamics of tert -Butyl Hydroperoxide at 193 nm

Shin, Seung Keun, Kim, Hong Lae, Park, Chan Ryang

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 62 KB

english, 1999

18

Structure and Magnetic Properties of Oxoverdazyl Radicals and Biradicals by an Integrated Computational Approach

Barone, Vincenzo, Bencini, Alessandro, Ciofini, Ilaria, Daul, Claude

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 131 KB

english, 1999

19

A Vacuum Ultraviolet Photoionization Mass Spectrometric Study of Ethylene Oxide in the Photon Energy Region of 10−40 eV

Liu, Fuyi, Qi, Fei, Gao, Hui, Sheng, Liusi, Zhang, Yunwu, Yu, Shuqin, Lau, Kai-Chung, Li, Wai-Kee

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 111 KB

english, 1999

20

Semiempirical Method for the Evaluation of Bond Covalency in Complex Crystals

Wu, Z. J., Zhang, S. Y.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 43 KB

english, 1999

21

Structures of the C 8 H 6+ Cation Formed upon Loss of Acetylene from Ionized Naphthalene

Schroeter, Katrin, Schröder, Detlef, Schwarz, Helmut

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 115 KB

english, 1999

22

Trimethylethoxysilane Liquid-Phase Hydrolysis Equilibrium and Dimerization Kinetics: Catalyst, Nonideal Mixing, and the Condensation Route

Rankin, Stephen E., Šefčík, Ján, McCormick, Alon V.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 113 KB

english, 1999

23

Reactions of Laser-Ablated Molybdenum and Tungsten Atoms with Nitric Oxide. Infrared Spectra of the MN, NMO, and M-η 1 -(NO) x ( x = 1, 2, 3, 4) Molecules and (NO) 2+ and (NO) 2- Ions in Solid Argon

Andrews, Lester, Zhou, Mingfei

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 113 KB

english, 1999

24

A Density-Functional Theory Investigation of the Radiation Products of l- α - Alanine

Ban, Fuqiang, Wetmore, Stacey D., Boyd, Russell J.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 75 KB

english, 1999

25

Photoconductivity Detected Magnetic Resonance Study on Photoinduced Electron-Transfer Reaction of Xanthone and N,N -Diethylaniline in 2-Propanol

Matsuyama, Akihito, Maeda, Kiminori, Murai, Hisao

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 76 KB

english, 1999

26

Mechanism of the Atmospheric Reaction between the Radical CH 3 SCH 2 and O 2

Resende, Stella M., De Almeida, Wagner B.

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 62 KB

english, 1999

27

Reactions of Laser-Ablated Iridium Atoms with O 2 . Infrared Spectra and DFT Calculations for Iridium Dioxide and Peroxo Iridium(VI) Dioxide in Solid Argon

Citra, Angelo, Andrews, Lester

Journal:

Journal of Physical Chemistry A

Year:

1999

Language:

english

File:

PDF, 102 KB

english, 1999