Volume 118; Issue 47

Journal of Physical Chemistry A

Volume 118; Issue 47

1

Vacuum Ultraviolet Photoionization Study of Gas Phase Vitamins A and B1 Using Aerosol Thermodesorption and Synchrotron Radiation

Dossmann, Héloïse, Schwarzenberg, Adrián, Lesage, Denis, Pérot-Taillandier, Marie, Afonso, Carlos, Cunha de Miranda, Barbara, Garcia, Gustavo A.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.91 MB

english, 2014

2

The Localization–Delocalization Matrix and the Electron-Density-Weighted Connectivity Matrix of a Finite Graphene Nanoribbon Reconstructed from Kernel Fragments

Timm, Matthew J., Matta, Chérif F., Massa, Lou, Huang, Lulu

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 2.67 MB

english, 2014

3

From Dissipative Dynamics to Studies of Heat Transfer at the Nanoscale: Analysis of the Spin-Boson Model

Boudjada, Nazim, Segal, Dvira

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 848 KB

english, 2014

4

Matrix Isolation Study of the Conformations and Photochemistry of S-Ethyl Fluorothioformate, FC(O)SCH 2 CH 3

Rodríguez Pirani, Lucas S., Erben, Mauricio F., Willner, Helge, Romano, Rosana M., Della Védova, Carlos O.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.14 MB

english, 2014

5

First-Principles Computational Visualization of Localized Surface Plasmon Resonance in Gold Nanoclusters

Iida, Kenji, Noda, Masashi, Ishimura, Kazuya, Nobusada, Katsuyuki

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 3.48 MB

english, 2014

6

Thermal Decomposition Mechanisms of Alkylimidazolium Ionic Liquids with Cyano-Functionalized Anions

Chambreau, Steven D., Schenk, Adam C., Sheppard, Anna J., Yandek, Gregory R., Vaghjiani, Ghanshyam L., Maciejewski, John, Koh, Christine J., Golan, Amir, Leone, Stephen R.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 2.58 MB

english, 2014

7

Detailed Mechanistic Studies into the Reactivities of Thiourea and Substituted Thiourea Oxoacids: Decompositions and Hydrolyses of Dioxides in Basic Media

Aslabban, Merfat M., Adigun, Risikat Ajibola, DeBenedetti, William, Mbiya, Wilbes, Mhike, Morgen, Morakinyo, Kayode, Otoikhian, Adenike, Ruwona, Tinashe, Simoyi, Reuben H.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.98 MB

english, 2014

8

Ab Initio Study of Energy Transfer Pathways in Dinuclear Lanthanide Complex of Europium(III) and Terbium(III) Ions

Romanova, Ksenia A., Freidzon, Alexandra Ya., Bagaturyants, Alexander A., Galyametdinov, Yury G.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 2.08 MB

english, 2014

9

Excitonic Splitting, Delocalization, and Vibronic Quenching in the Benzonitrile Dimer

Balmer, Franziska A., Ottiger, Philipp, Leutwyler, Samuel

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.28 MB

english, 2014

10

Ultrafast Dissociation Dynamics of [Fe(CO) 5 ] n Clusters Induced by Femtosecond IR Radiation

Poydashev, Denis G., Lokhman, Valery N., Kompanets, Victor O., Chekalin, Sergey V., Ryabov, Evgeny A.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 910 KB

english, 2014

11

Dissociative Photoionization and Threshold Photoelectron Spectra of Polycyclic Aromatic Hydrocarbon Fragments: An Imaging Photoelectron Photoion Coincidence (iPEPICO) Study of Four Substituted Benzene Radical Cations

West, Brandi, Sit, Alicia, Bodi, Andras, Hemberger, Patrick, Mayer, Paul M.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 3.09 MB

english, 2014

12

Dynamics Simulations and Statistical Modeling of Thermal Decomposition of 1-Ethyl-3-methylimidazolium Dicyanamide and 1-Ethyl-2,3-dimethylimidazolium Dicyanamide

Liu, Jianbo, Chambreau, Steven D., Vaghjiani, Ghanshyam L.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 3.12 MB

english, 2014

13

Decomposition of Diazomeldrum’s Acid: A Threshold Photoelectron Spectroscopy Study

Lang, Melanie, Holzmeier, Fabian, Fischer, Ingo, Hemberger, Patrick

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 2.54 MB

english, 2014

14

A Full-Dimensional Global Potential Energy Surface of H 3 O + (ã 3 A) for the OH + (X̃ 3 Σ – ) + H 2 (X̃ 1 Σ g+ ) → H( 2 S) + H 2 O + (X̃ 2 B 1 ) Reaction

Li, Anyang, Guo, Hua

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.39 MB

english, 2014

15

Direct Observation of Hole Shift and Characterization of Spin States in Radical Ion Pairs Generated from Photoinduced Electron Transfer of (Phenothiazine) n –Anthraquinone ( n = 1, 3) Dyads

Karimata, Ayumu, Suzuki, Shuichi, Kozaki, Masatoshi, Kimoto, Kenshi, Nozaki, Koichi, Matsushita, Hironori, Ikeda, Noriaki, Akiyama, Kimio, Kosumi, Daisuke, Hashimoto, Hideki, Okada, Keiji

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.25 MB

english, 2014

16

Structural Determination and Gas-Phase Synthesis of Monomeric, Unsolvated IZnCH 3 ( X̃ 1 A 1 ): A Model Organozinc Halide

Bucchino, Matthew P., Young, Justin P., Sheridan, Phillip M., Ziurys, Lucy M.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.35 MB

english, 2014

17

Charge Delocalization in an Organic Mixed Valent Bithiophene Is Greater Than in a Structurally Analogous Biselenophene

Jahnke, Ann Christin, Proppe, Jonny, Spulber, Mariana, Palivan, Cornelia G., Herrmann, Carmen, Wenger, Oliver S.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.90 MB

english, 2014

18

Kinetics of C–C and C–H Bond Cleavage in Phenyl Alkane Radical Cations Generated by Photoinduced Electron Transfer

Cyr, Douglas, Das, Paritosh

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.92 MB

english, 2014

19

Complex Frequency-Dependent Polarizability through the π → π* Excitation Energy of Azobenzene Molecules by a Combined Charge-Transfer and Point-Dipole Interaction Model

Haghdani, Shokouh, Davari, Nazanin, Sandnes, Runar, Åstrand, Per-Olof

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.09 MB

english, 2014

20

On the Participation of Photoinduced N–H Bond Fission in Aqueous Adenine at 266 and 220 nm: A Combined Ultrafast Transient Electronic and Vibrational Absorption Spectroscopy Study

Roberts, Gareth M., Marroux, Hugo J. B., Grubb, Michael P., Ashfold, Michael N. R., Orr-Ewing, Andrew J.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 3.87 MB

english, 2014

21

Fermi Resonance Effects in the Vibrational Spectroscopy of Methyl and Methoxy Groups

Sibert, Edwin L., Tabor, Daniel P., Kidwell, Nathanael M., Dean, Jacob C., Zwier, Timothy S.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.07 MB

english, 2014

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