Volume 101; Issue 11

Journal of Physical Chemistry A

Volume 101; Issue 11

1

Electron Transfer from Cyclohexane to Photoexcited Aromatic Ions. Generation and Kinetics of High-Mobility Solvent Holes†

Shkrob, I. A., Sauer, M. C., Schmidt, K. H., Liu, A. D., Yan, J., Trifunac, A. D.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 107 KB

english, 1997

2

Electron-Energy-Loss Spectroscopy and Theoretical Study of Triplet and Singlet Excited States of Fulvene

Asmis, Knut R., Allan, Michael, Schafer, Olivier, Fülscher, Markus

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 363 KB

english, 1997

3

Weak Temperature Dependence in the Magnetic Circular Dichroism of Matrix-Isolated Copper Phthalocyanine

Dunford, Cara L., Williamson, Bryce E.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 208 KB

english, 1997

4

Predictions of Crystal Packings for Uracil, 6-Azauracil, and Allopurinol: The Interplay between Hydrogen Bonding and Close Packing

Price, Sarah L., Wibley, Keith S.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 178 KB

english, 1997

5

Connecting Cluster Anion Properties to Bulk: Ion Solvation Free Energy Trends with Cluster Size and the Surface vs Internal Nature of Iodide in Water Clusters

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 187 KB

english, 1997

6

Electron Transfer Chemistry of Psoralen and Coumarin Derivatives by Means of Radiolytic and Electrochemical Experiments

Chen, Tonqgian, Platz, Matthew S., Robert, Marc, Savéant, Jean-Michel, Marcinek, Andrzej, Rogowski, Jacek, Gebicki, Jerzy, Zhu, Zhendong, Bally, Thomas

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 316 KB

english, 1997

7

Effect of S 1 Torsional Dynamics on the Time-Resolved Fluorescence Spectra of 9,9‘-Bianthryl in Solution

Elich, Karsten, Kitazawa, Minoru, Okada, Tadashi, Wortmann, Rüdiger

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 186 KB

english, 1997

8

Ab Initio Calculations of the Ground Electronic States of Polyiodide Anions

Sharp, Stephanie B., Gellene, Gregory I.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 134 KB

english, 1997

9

Kinetics of C 2 Reactions during High-Temperature Pyrolysis of Acetylene

Kruse, T., Roth, P.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 266 KB

english, 1997

10

Chemical Bonding between Cu and OxygenCopper Oxides vs O 2 Complexes: A Study of CuO x ( x = 0−6) Species by Anion Photoelectron Spectroscopy

Wu, Hongbin, Desai, Sunil R., Wang, Lai-Sheng

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 582 KB

english, 1997

11

Electronic Structure of the BF 2 Radical Determined by ab Initio Calculations and Resonance-Enhanced Multiphoton Ionization Spectroscopy

Atkinson, Dean B., Irikura, Karl K., Hudgens, Jeffrey W.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 135 KB

english, 1997

12

Experimental Design in Global Compartmental Analysis of Reversible Intramolecular Two-State Excited-State Processes with Added Quencher

Dutt, G. Bhaskar, Boens, Noël, Kowalczyk, Andrzej, De Schryver, Frans C., Ameloot, Marcel

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 320 KB

english, 1997

13

Effect of Light on the Belousov−Zhabotinsky Reaction in Water-in-Oil Microemulsions of Aerosol OT in Octane

Vanag, Vladimir K., Hanazaki, Ichiro

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 225 KB

english, 1997

14

Excited Singlet State Reactions of Triphenylpyrylium Ion with Electron Donors: Evidence for Electron Transfer and the Observation of Marcus Inverted Region for the Charge Shift in the Radical Pair

Jayanthi, S. S., Ramamurthy, P.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 185 KB

english, 1997

15

Incubation and Photoablation of Poly(methyl methacrylate) at 248 nm. New Insight into the Reaction Mechanism Using Photofragment Translational Spectroscopy

Krajnovich, Douglas J.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 272 KB

english, 1997

16

Solvent Dependence of the First Molecular Hyperpolarizability of p -Nitroaniline Revisited

Woodford, J. N., Pauley, M. A., Wang, C. H.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 171 KB

english, 1997

17

Efficiency of the Local Torsional Deformations Method for Identifying the Stable Structures of Cyclic Molecules

Baysal, Canan, Meirovitch, Hagai

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 136 KB

english, 1997

18

Structures of C n H x + Molecules for n ≤ 22 and x ≤ 5: Emergence of PAHs and Effects of Dangling Bonds on Conformation

Lee, Seonghoon, Gotts, Nigel, von Helden, Gert, Bowers, Michael T.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 209 KB

english, 1997

19

A Numerical Method for the Topological Analysis of the Laplacian of the Electronic Charge Density in Molecules and Solids

Aray, Yosslen, Rodríguez, Jesús, López-Boada, Roberto

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 322 KB

english, 1997

20

Heterogeneous Interactions of HBr and HOCl with Cold Sulfuric Acid Solutions: Implications for Arctic Boundary Layer Bromine Chemistry

Abbatt, Jonathan P. D., Nowak, John B.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 250 KB

english, 1997

21

Relaxation Paths from a Conical Intersection: The Mechanism of Product Formation in the Cyclohexadiene/Hexatriene Photochemical Interconversion

Garavelli, Marco, Celani, Paolo, Fato, Monica, Bearpark, Michael J., Smith, Barry R., Olivucci, Massimo, Robb, Michael A.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 432 KB

english, 1997

22

Gas-Phase Metal Ion Ligation: Collision-Induced Dissociation of Fe(N 2 ) x + ( x = 1−5) and Fe(CH 2 O) x + ( x = 1−4)

Tjelta, Brenda L., Armentrout, P. B.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 220 KB

english, 1997

23

Crystallization Kinetics of HNO 3 /H 2 O Films Representative of Polar Stratospheric Clouds

Tisdale, Robert T., Middlebrook, Ann M., Prenni, Anthony J., Tolbert, Margaret A.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 419 KB

english, 1997

24

Calculation of Static Third-Order Polarizabilities of Large Organic Molecules

Cardelino, B. H., Moore, C. E., Frazier, D. O.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 293 KB

english, 1997

25

Radiolytic Studies of the Mechanism of Autoxidation of Triphenylphosphine and Related Compounds

Alfassi, Z. B., Neta, P., Beaver, Bruce

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 178 KB

english, 1997

26

G2 Study of the Triplet and Singlet [H 3 , P 2 ] + Potential Energy Surfaces. Mechanisms for the Reaction of P + ( 1 D, 3 P) with PH 3

Cruz, Elso M., Lopez, Xabier, Ayerbe, Mirari, Ugalde, Jesus M.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 189 KB

english, 1997

27

Orange Flame from Active Nitrogen and Oxygen in the Absence of a Metal Catalyst Resulting from Collisional Intersystem Crossing into N 2 (B 3 Π g )

Kamaratos, Efstathios

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 151 KB

english, 1997

28

Effects of Additional Linkers in Biphenyl-4,4‘-dinitrene on the Low-Lying Singlet−Triplet Energy Gap and Zero-Field Splitting

Nimura, Shigeaki, Kikuchi, Osamu, Ohana, Tsuguyori, Yabe, Akira, Kondo, Shigeo, Kaise, Masahiro

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 255 KB

english, 1997

29

Structures and Conformations of CF 3 SC(O)F and CF 3 SC(O)Cl: Gas-Phase Electron Diffraction, Vibrational Analysis, and Theoretical Calculations

Gobbato, Karina I., Mack, Hans-Georg, Oberhammer, Heinz, Ulic, Sonia E., Della Védova, Carlos O., Willner, Helge

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 160 KB

english, 1997

30

Solvent Effect on the Electronic Structure of Molecules Studied by the Langevin Dipoles/Monte Carlo Approach

Lipiński, Józef, Bartkowiak, Wojciech

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 168 KB

english, 1997

31

Photochemical Reaction of Ozone with Chloroiodomethane and Bromochloromethane in Solid Argon at 14 K. FTIR Spectra of the Intermediate, CH 2 ClIO, and the Complexes HC(O)Cl···HI, HC(O)Cl···HBr, HC(O)Br···HCl, COBrCl, (CO)(HCl)(HI), and (CO)(HBr)(HCl)

Clark, Robin J. H., Dann, Jonathan R.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 356 KB

english, 1997

32

Photochemically Induced Electronic-To-Electronic Energy Transfer in Geminate CO···O van der Waals Pair Generated through Vacuum Ultraviolet Photolysis of CO 2 in Ar Matrices

Gudipati, Murthy S.

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 164 KB

english, 1997