Volume 118; Issue 21

Journal of Physical Chemistry A

Volume 118; Issue 21

1

Infrared Absorption Spectra of Jahn–Teller Systems: Application to the Transition-Metal Trifluorides MnF 3 and NiF 3

Mondal, Padmabati, Domcke, Wolfgang

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.18 MB

english, 2014

2

Revisiting the Calculation of I / V Profiles in Molecular Junctions Using the Uncertainty Principle

Ramos-Berdullas, Nicolás, Mandado, Marcos

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.96 MB

english, 2014

3

Why Is the L-Shaped Structure of X 2 ···X 2 (X = F, Cl, Br, I) Complexes More Stable Than Other Structures?

Sedlak, Robert, Deepa, Palanisamy, Hobza, Pavel

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.59 MB

english, 2014

4

Substituent Effects in the Noncovalent Bonding of SO 2 to Molecules Containing a Carbonyl Group. The Dominating Role of the Chalcogen Bond

Azofra, Luis Miguel, Scheiner, Steve

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.83 MB

english, 2014

5

Substituent and Solvent Effects on the Absorption Spectra of Cation−π Complexes of Benzene and Borazine: A Theoretical Study

Sarmah, Nabajit, Bhattacharyya, Pradip Kr., Bania, Kusum K.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 7.63 MB

english, 2014

6

Persistent Intramolecular C–H···X (X = O or S) Hydrogen-Bonding in Benzyl Meldrum’s Acid Derivatives

Hopkins, W. Scott, Hasan, Moaraj, Burt, Michael, Marta, Rick A., Fillion, Eric, McMahon, Terry B.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.18 MB

english, 2014

7

Effect of Proton Substitution by Alkali Ions on the Fluorescence Emission of Rhodamine B Cations in the Gas Phase

Greisch, Jean-François, Harding, Michael E., Klopper, Wim, Kappes, Manfred M., Schooss, Detlef

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.49 MB

english, 2014

8

Spectral and Kinetic Properties of Radical Cations Derived from Oxoisoaporphines: Relevance to Electron-Transfer Processes Involving Phytoalexins

De la Fuente, Julio R., Kciuk, Gabriel, Aliaga, Christian, Bobrowski, Krzysztof

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.72 MB

english, 2014

9

Gas-Phase Synthesis of Boronylallene (H 2 CCCH(BO)) under Single Collision Conditions: A Crossed Molecular Beams and Computational Study

Maity, Surajit, Parker, Dorian S. N., Kaiser, Ralf I., Ganoe, Brad, Fau, Stefan, Perera, Ajith, Bartlett, Rodney J.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 5.77 MB

english, 2014

10

Symmetry Breaking in Platinum Acetylide Chromophores Studied by Femtosecond Two-Photon Absorption Spectroscopy

Rebane, Aleksander, Drobizhev, Mikhail, Makarov, Nikolay S., Wicks, Geoffrey, Wnuk, Pawel, Stepanenko, Yuriy, Haley, Joy E., Krein, Douglas M., Fore, Jennifer L., Burke, Aaron R., Slagle, Jonathan E.,

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 2.46 MB

english, 2014

11

Experimental and Computational Thermochemistry of 3- and 4-Nitrophthalic Anhydride

García-Castro, Miguel A., Amador, Patricia, Hernández-Pérez, Julio M., Medina-Favela, Adrián E., Flores, Henoc

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 953 KB

english, 2014

12

Gas Phase Structure of Metal Mediated (Cytosine) 2 Ag + Mimics the Hemiprotonated (Cytosine) 2 H + Dimer in i -Motif Folding

Berdakin, Matias, Steinmetz, Vincent, Maitre, Philippe, Pino, Gustavo A.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 1.73 MB

english, 2014

13

Synchrotron Photoionization Study of Mesitylene Oxidation Initiated by Reaction with Cl( 2 P) or O( 3 P) Radicals

Ng, Martin Y., Nelson, Jordan, Taatjes, Craig A., Osborn, David L., Meloni, Giovanni

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 2.24 MB

english, 2014

14

Light-Induced Structural Change in Iridium Complexes Studied by Electron Spin Resonance

Batagin-Neto, A., Assis, A. P., Lima, J. F., Magon, C. J., Yan, L., Shao, M., Hu, B., Graeff, C. F. O.

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 2.91 MB

english, 2014

15

Kinetic Studies on the Synthesis of Monoclinic Li 3 V 2 (PO 4 ) 3 via Solid-State Reaction

Chen, Shanhua, Wu, Jun, Su, Zelong, Deng, Ling

Journal:

Journal of Physical Chemistry A

Year:

2014

Language:

english

File:

PDF, 599 KB

english, 2014

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