Volume 106; Issue 36

Journal of Physical Chemistry A

Volume 106; Issue 36

1

Rate Constants, 1100 ≤ T ≤ 2000 K, for H + NO2 → OH + NO Using Two Shock Tube Techniques: Comparison of Theory to Experiment†

Su, M.-C., Kumaran, S. S., Lim, K. P., Michael, J. V., Wagner, A. F., Harding, L. B., Fang, D.-C.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 398 KB

english, 2002

2

Measurements of Pressure-Broadening Coefficients for the F‘ = 3 ← F‘ ‘ = 4 Hyperfine Line of the 2 P 1/2 ← 2 P 3/2 Transition in Atomic Iodine †

Davis, S. J., Mulhall, P. A., Bachman, M., Kessler, W. J., Keating, P. B.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 147 KB

english, 2002

3

Unimolecular HCl Elimination from 1,2-Dichloroethane: A Single Pulse Shock Tube and ab Initio Study †

Rajakumar, B., Reddy, K. P. J., Arunan, E.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 137 KB

english, 2002

4

Trajectory-Surface-Hopping Study of the Renner−Teller Effect in the N( 2 D) + H 2 Reaction †

Santoro, Fabrizio, Petrongolo, Carlo, Schatz, George C.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 182 KB

english, 2002

5

Rate Constants for the CH 4 + H → CH 3 + H 2 Reaction Calculated with a Generalized Reduced-Dimensionality Method †

Palma, Juliana, Echave, Julián, Clary, David C.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 44 KB

english, 2002

6

Hydrogen Atom Reactions with Molecular Halogens: The Rate Constants for H + F 2 and H + Cl 2 at 298 K †

Han, Jiande, Heaven, Michael C., Manke, Gerald C.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 85 KB

english, 2002

7

Energy Transfer Kinetics of N 2 (X 1 , v ) and SiH 4†

Piper, Lawrence G.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 365 KB

english, 2002

8

The Ionization Potential of Si 2 N and Si 2 O †

Paukstis, S. J., Gole, J. L., Dixon, David A., Peterson, Kirk A.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 237 KB

english, 2002

9

Atmospheric Chemistry of CF 3 CH 2 OCHF 2 and CF 3 CHClOCHF 2 : Kinetics and Mechanisms of Reaction with Cl Atoms and OH Radicals and Atmospheric Fate of CF 3 C(O•)HOCHF 2 and CF 3 C(O•)ClOCHF 2 Radicals †

Wallington, T. J., Hurley, M. D., Fedotov, V., Morrell, C., Hancock, G.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 165 KB

english, 2002

10

High-Resolution Laser Spectroscopy of CaS: Deperturbation Analysis of the A 1 Σ + −X 1 Σ + Transition †

Melville, Todd C., Coxon, John A.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 96 KB

english, 2002

11

Product Studies of Inelastic and Reactive Collisions of NH 2 + NO: Effects of Vibrationally and Electronically Excited NH 2†

Marcy, Timothy P., Heard, Dwayne E., Leone, Stephen R.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 137 KB

english, 2002

12

Autobiographical Sketch of Don Setser

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 17 KB

english, 2002

13

Kinetics of O 2 ( 1 Σ g+ ) Reaction with H 2 and an Upper Limit for OH Production †

Talukdar, Ranajit K., Dunlea, Edward J., Brown, Steven S., Daniel, John S., Ravishankara, A. R.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 214 KB

english, 2002

14

Experimental Rate Measurements for NS + NO, O 2 and NO 2 , and Electronic Structure Calculations of the Reaction Paths for NS + NO 2†

Blitz, Mark A., McKee, Kenneth W., Pilling, Michael J., Vincent, Mark A., Hillier, Ian H.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 84 KB

english, 2002

15

Strong-Field Excitation of Liquid and Solid Xe Using Intense Femtosecond Pulses †

Pettersson, M., Zadoyan, R., Eloranta, J., Schwentner, N., Apkarian, V. A.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 214 KB

english, 2002

16

Preface to the Donald W. Setser Festschrift

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 33 KB

english, 2002

17

Bromine Nitrate Photochemistry: Quantum Yields for O, Br, and BrO Over the Wavelength Range 248−355 nm †

Soller, R., Nicovich, J. M., Wine, P. H.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 89 KB

english, 2002

18

Spin−Orbit and Vibrational Relaxation Rate Constants and Radiative Lifetimes for v ‘=0−5 Levels of PF(A 3 Π 0,1,2) Molecules †

Nizamov, Boris, Setser, D. W.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 214 KB

english, 2002

19

Ab Initio Studies of ClO x Reactions. 2. Unimolecular Decomposition of s-ClO 3 and the Bimolecular O + OClO Reaction †

Zhu, R. S., Lin, M. C.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 88 KB

english, 2002

20

Relationship between Mode Specific and Thermal Unimolecular Rate Constants for HOCl → OH + Cl Dissociation †

Song, Kihyung, Sun, Lipeng, Hase, William L., Grebenshchikov, S. Yu., Schinke, Reinhard

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 104 KB

english, 2002

21

Photodissociation of Gaseous NCl 3 at 193 and 249 nm †

Coombe, R. D., Gilbert, J. V., Beaton, S. S., Mateljevic, N.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 110 KB

english, 2002

22

Comparisons between Density Functional Theory and Conventional ab Initio Methods for 1,2-Elimination of HF from 1,1,1-Trifluoroethane: Test Case Study for HF Elimination from Fluoroalkanes †

Martell, Jaime M., Beaton, Paul T., Holmes, Bert E.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 66 KB

english, 2002

23

Colleagues of Don Setser

Journal:

Journal of Physical Chemistry A

Year:

2002

File:

PDF, 6 KB

2002

24

An ab Initio Excursion on the Lowest 18 Electronic Surfaces of the NCl + NCl System: Some Insight into the Long-Range Self-Quenching Pathways of the First Excited State of NCl †

Tschumper, Gregory S., Heaven, Michael C., Morokuma, Keiji

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 282 KB

english, 2002

25

Research Publications

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 80 KB

english, 2002

26

Wide-Temperature Range Kinetics and CN(B−X) Violet Chemiluminescence of the C 2 (a 3 Π) + NO Reaction †

Ristanovic, Aleksandra, Fernandez, Abel, Fontijn, Arthur

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 78 KB

english, 2002

27

Semiclassical Calculations of Tunneling Splitting in Hydrogen Peroxide and Its Deuterated Isotopomers †

Guo, Yin, Thompson, Donald L.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 43 KB

english, 2002

28

Experimental and Theoretical Study of State-Resolved Electronically Inelastic Collisions of Highly Rotationally Excited CN(A 2 Π) with Argon and Helium: The Role of Gateway Levels †

Nizamov, Boris, Yang, Xin, Dagdigian, Paul J., Alexander, Millard H.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 147 KB

english, 2002

29

Photodissociation Dynamics of CH 2 ICl at 222, 236, 266, 280, and ∼304 nm †

Senapati, Dulal, Kavita, K., Das, Puspendu K.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 65 KB

english, 2002

30

Reactions of Metastable Argon Atoms with Molecular Hydrogen at 300 and 80 K: Origin of the Ultraviolet Chemiluminescence

Sadeghi, N., Setser, D. W., Touzeau, M.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 125 KB

english, 2002

31

Ionization Energies and Dyson Orbitals of Thymine and Other Methylated Uracils †

Dolgounitcheva, O., Zakrzewski, V. G., Ortiz, J. V.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 454 KB

english, 2002

32

Beam Study of the Luminescent E−E Energy Transfer Reaction Kr( 3 P 2 ) + N 2 → Kr + N 2 (B 3 Π g ) at High Resolution and Variable Collision Energy †

Bachmann, R., Ehlich, R., Ottinger, Ch., Rox, T., Sadeghi, N.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 207 KB

english, 2002

33

Vibrationally Mediated Photodissociation of Jet-Cooled CH 3 CF 2 Cl: A Probe of Energy Flow and Bond Breaking Dynamics †

Dorfman, Gabriela, Melchior, Aviva, Rosenwaks, Salman, Bar, Ilana

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 85 KB

english, 2002

34

Precise Characterization of the B ( 1 / 2 ) and C ( 3 / 2 ) States of XeF from a Deperturbation Analysis of the B → X Spectrum of 136 XeF †

Tellinghuisen, Patricia C., Tellinghuisen, Joel

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 80 KB

english, 2002

35

Rate Constants for Quenching and Self-Annihilation of NCl( a 1 Δ) †

Komissarov, Anatoly V., Manke, Gerald C., Davis, S. J., Heaven, Michael C.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 144 KB

english, 2002

36

Reactions of C( 3 P) and C + ( 2 P) with NH 3 Studied Spectroscopically at Hyperthermal Energies †

Ottinger, Christoph, Kowalski, Andrzej

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 201 KB

english, 2002

37

Collisional Transfer between Λ-Doublet Levels of OH(X 2 Π 3/2 , v = 1, j = 3.5, and 6.5) in Collisions with He, Ar, N 2 , and HNO 3†

Hickson, Kevin M., Sadowski, Chester M., Smith, Ian W. M.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 127 KB

english, 2002

38

Calculations of Long Range Potential Wells for Cs 2 Molecules below the Cs ( n s, n ≥ 8) + Cs (6s) Asymptotes †

Normand, Bradford, Zemke, Warren T., Côté,, Robin, Pichler, Marin, Stwalley, William C.

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 46 KB

english, 2002