Volume 112; Issue 31

Journal of Physical Chemistry A

Volume 112; Issue 31

1

Ground- and Excited-State Aromaticity and Antiaromaticity in Benzene and Cyclobutadiene

Karadakov, Peter B.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 90 KB

english, 2008

2

Photophysics and Nonlinear Absorption of Peripheral-Substituted Zinc Phthalocyanines

Li, Yunjing, Pritchett, Timothy M., Huang, Jiandong, Ke, Meirong, Shao, Pin, Sun, Wenfang

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 821 KB

english, 2008

3

Vibrational Relaxation of Highly Vibrationally Excited O 3 in Collisions with OH

Zhang, Lei, Luo, Pingya, Huang, Zhiyu, Chen, Hong, Varandas, António J. C.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 118 KB

english, 2008

4

Kinetics of Metal Ion Binding by Polysaccharide Colloids

Rotureau, Elise, van Leeuwen, Herman P.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 257 KB

english, 2008

5

Continuum Electrostatics for Electronic Structure Calculations in Bulk Amorphous Polymers: Application to Polylactide

McAliley, James H., O’Brien,, Christopher P., Bruce, David A.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 525 KB

english, 2008

6

Experimental and Ab Initio Dynamical Investigations of the Kinetics and Intramolecular Energy Transfer Mechanisms for the OH + 1,3-Butadiene Reaction between 263 and 423 K at Low Pressure

Vimal, Deepali, Pacheco, Alexander B., Iyengar, Srinivasan S., Stevens, Philip S.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 1.42 MB

english, 2008

7

Nonplanarity of Adenine: Vibrational Transition Moment Angle Studies in Helium Nanodroplets

Choi, Myong Yong, Dong, Feng, Han, Sang Woo, Miller, Roger E.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 1.11 MB

english, 2008

8

Understanding Reaction Mechanisms in Organic Chemistry from Catastrophe Theory Applied to the Electron Localization Function Topology

Polo, Victor, Andres, Juan, Berski, Slawomir, Domingo, Luis R., Silvi, Bernard

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 1.16 MB

english, 2008

9

Bond Multiplicity in Transition-Metal Complexes: Applications of Two-Electron Valence Indices

Michalak, Artur, DeKock, Roger L., Ziegler, Tom

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 875 KB

english, 2008

10

Theoretical Insights on the Electronic Properties of Eosin Y, an Organic Dye for Photovoltaic Applications

Hazebroucq, Sandrine, Labat, Frédéric, Lincot, Daniel, Adamo, Carlo

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 781 KB

english, 2008

11

Vibration−Rotation Spectroscopy of Molecules Trapped inside C 60

Cross, R. James

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 83 KB

english, 2008

12

Evidence for Rydberg Doorway States in Photoion Pair Formation in Bromomethane

Ridley, Trevor, Hennessy, John T., Donovan, Robert J., Lawley, Kenneth P., Wang, Shiliang, Brint, Paul, Lane, Eoin

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 132 KB

english, 2008

13

Infrared Spectra of the Sulfenic Ester CH 3 SOCH 3 and Its Photodissociation Products in Solid Argon

Chen, Mohua, Yang, Rongjing, Ma, Renhu, Zhou, Mingfei

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 110 KB

english, 2008

14

Spectroscopic Investigations of High-Power Laser-Induced Dielectric Breakdown in Gas Mixtures Containing Carbon Monoxide

Civiš, Svatopluk, Babánková, Dagmar, Cihelka, Jaroslav, Sazama, Petr, Juha, Libor

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 197 KB

english, 2008

15

Anomalously Large Difference in Dipole Moment of Isomers with Nearly Identical Thermodynamic Stability

Nadykto, Alexey B., Yu, Fangqun

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 1.30 MB

english, 2008

16

Coordination and Haptotropic Migration of Cr(CO) 3 in Polycyclic Aromatic Hydrocarbons: The Effect of the Size and the Curvature of the Substrate

Jiménez-Halla, J. Oscar C., Robles, Juvencio, Solà, Miquel

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 32 KB

english, 2008

17

Clustering Dynamics of the Metal−Benzene Sandwich Complex: The Role of Microscopic Structure of the Solute In the Bis(η 6 -benzene)chromium ·Ar n Clusters ( n = 1−15)

Choi, Kyo-Won, Choi, Sunyoung, Ahn, Doo-Sik, Han, Songhee, Kang, Tae Yeon, Baek, Sun Jong, Kim, Sang Kyu

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 197 KB

english, 2008

18

Neutral and Charged Excited States in Polar Organic Films: Origin of Unusual Electroluminescence in Tri- p -tolylamine-Based Hole Conductors

Mukhopadhyay, S., Topham, B. J., Soos, Z. G., Ramasesha, S.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 143 KB

english, 2008

19

Intramolecular Excimer Formation and Photoinduced Electron-Transfer Process in Bis-1,8-Naphthalimide Dyads Depending on the Linker Length

Cho, Dae Won, Fujitsuka, Mamoru, Sugimoto, Akira, Majima, Tetsuro

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 683 KB

english, 2008

20

Tetragonal Distortion of Structural Defects in Cr 3+ Doped in Several Perovskites Calculated from the EPR and Optical Data: A Complete Energy Matrix Study

Mao, Ai-Jie, Kuang, Xiao-Yu

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 312 KB

english, 2008

21

Metal Speciation Dynamics in Monodisperse Soft Colloidal Ligand Suspensions

Duval, Jérôme F. L., Pinheiro, José P., Leeuwen, Herman P. van

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 540 KB

english, 2008

22

Searching for Conical Intersections of Potential Energy Surfaces with the ONIOM Method: Application to Previtamin D

Bearpark, Michael J., Larkin, Susan M., Vreven, Thom

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 206 KB

english, 2008

23

Conformationally Specific Vacuum Ultraviolet Mass-Analyzed Threshold Ionization Spectroscopy of Alkanethiols: Structure and Ionization of Conformational Isomers of Ethanethiol, Isopropanethiol, 1-Propanethiol, tert -Butanethiol, and 1-Butanethiol

Choi, Sunyoung, Kang, Tae Yeon, Choi, Kyo-Won, Han, Songhee, Ahn, Doo-Sik, Baek, Sun Jong, Kim, Sang Kyu

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 769 KB

english, 2008

24

Parallel and Coupled Perpendicular Transitions of RbCs 640 nm System: Mass-Resolved Resonance Enhanced Two-Photon Ionization in a Cold Molecular Beam

Lee, Yonghoon, Yoon, Youngjee, Lee, Sungyul, Kim, Jin-Tae, Kim, Bongsoo

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 945 KB

english, 2008

25

Vibrational Spectra of the Boron Halides and Their Molecular Complexes. Part 11. Complexes of Boron Trifluoride with Phosphine and Its Methyl Derivatives. An ab Initio Study

Ford, Thomas A.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 125 KB

english, 2008

26

Conformational Behavior of Cinchonidine Revisited: A Combined Theoretical and Experimental Study

Urakawa, Atsushi, Meier, Daniel M., Rüegger,, Heinz, Baiker, Alfons

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 2.37 MB

english, 2008

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