Volume 110; Issue 36

Journal of Physical Chemistry A

Volume 110; Issue 36

1

Master Equation Methods in Gas Phase Chemical Kinetics

Miller, James A., Klippenstein, Stephen J.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 431 KB

english, 2006

2

Study of the Complexation of Fisetin with Cyclodextrins

Guzzo, Mariana R., Uemi, Miriam, Donate, Paulo M., Nikolaou, Sofia, Machado, Antonio Eduardo H., Okano, Laura T.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 118 KB

english, 2006

3

Origin of the Attraction in Aliphatic C−H/π Interactions: Infrared Spectroscopic and Theoretical Characterization of Gas-Phase Clusters of Aromatics with Methane

Morita, So-ichi, Fujii, Asuka, Mikami, Naohiko, Tsuzuki, Seiji

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 187 KB

english, 2006

4

Effect of Temperature and Concentration on the Structure of s ec -Butyl Alcohol and Isobutyl Alcohol/Water Mixtures: Near-Infrared Spectroscopic Study

Wojtków, Dagmara, Czarnecki, Mirosław A.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 258 KB

english, 2006

5

Reply to “Comment on the Paper ‘On the Limits of Highest-Occupied Molecular Orbital Driven Reactions: The Frontier Effective-for-Reaction Molecular Orbital Concept'”

da Silva, Rodrigo R., Ramalho, Teodorico C., Santos, Joana M., Figueroa-Villar, J. Daniel

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 13 KB

english, 2006

6

Reactions of Early Lanthanide Metal Atoms (Nd, Sm, Eu) with Water Molecules. A Matrix Isolation Infrared Spectroscopic and Theoretical Study

Xu, Jia, Zhou, Mingfei

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 146 KB

english, 2006

7

Structure of the Boronic Acid Dimer and the Relative Stabilities of Its Conformers

Larkin, Joseph D., Bhat, Krishna L., Markham, George D., Brooks, Bernard R., Schaefer, Henry F., Bock, Charles W.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 250 KB

english, 2006

8

Control Goal Selection through Anticorrelation Analysis in the Detection Space

Tran, Huyen T., Romanov, Dmitri A., Levis, Robert J.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 105 KB

english, 2006

9

Rise in the pH of an Unfrozen Solution in Ice Due to the Presence of NaCl and Promotion of Decomposition of Gallic Acids Owing to a Change in the pH

Takenaka, Norimichi, Tanaka, Masayuki, Okitsu, Kenji, Bandow, Hiroshi

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 92 KB

english, 2006

10

Insights into the Mechanism of BN Generation via Boron Triazide Precursor: Theoretical Study

Liu,, Meng,, Sun, Zheng, Zheng,

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 498 KB

english, 2006

11

Calculation of Vibrational Spectra of Linear Tetrapyrroles. 4. Methine Bridge C−H Out-of-Plane Modes

Mroginski, Maria Andrea, Murgida, Daniel Horacio, Hildebrandt, Peter

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 375 KB

english, 2006

12

A New Approach to Determining Gas-Particle Reaction Probabilities and Application to the Heterogeneous Reaction of Deliquesced Sodium Chloride Particles with Gas-Phase Hydroxyl Radicals

Laskin, Alexander, Wang, Hai, Robertson, William H., Cowin, James P., Ezell, Michael J., Finlayson-Pitts, Barbara J.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 351 KB

english, 2006

13

Density Functional Theory Prediction of Enhanced Photomagnetic Properties of Nitronyl Nitroxide and Imino Nitroxide Diradicals with Substituded Dihydropyrene Couplers

Ali, Md. Ehesan, Datta, Sambhu N.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 91 KB

english, 2006

14

Theoretical Studies on the Low-Lying Electronic States of the HSO Neutral Radical and Its Cation

Li, Bu-Tong, Wei, Zi-Zhang, Zhang, Hong-Xing, Sun, Chia-chung

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 170 KB

english, 2006

15

Comment on the Paper “On the Limits of Highest-Occupied Molecular Orbital Driven Reactions: The Frontier Effective-for-Reaction Molecular Orbital Concept”

Maksić, Zvonimir B., Vianello, Robert

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 18 KB

english, 2006

16

Reactions of Methyl Fluoride with Atomic Transition-Metal and Main-Group Cations: Gas-Phase Room-Temperature Kinetics and Periodicities in Reactivity

Zhao, Xiang, Koyanagi, Gregory K., Bohme, Diethard K.

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 462 KB

english, 2006

17

Solvent and Pressure Effects on Quenching by Oxygen of 9,10-Dimethylanthracene Fluorescence in Liquid n -Alkanes: A Study on Solvent Cage Effects

Okamoto, Masami, Tanaka, Fujio

Journal:

Journal of Physical Chemistry A

Year:

2006

Language:

english

File:

PDF, 124 KB

english, 2006

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