Volume 112; Issue 7

Journal of Physical Chemistry A

Volume 112; Issue 7

1

Time-Resolved Resonance Raman Observation of the Dimerization of Didehydroazepines in Solution

Xue, Jiadan, Du, Yong, Chuang, Yung Ping, Phillips, David Lee, Wang, Jin, Luk, Calvin, Hadad, Christopher M., Platz, Matthew S.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 235 KB

english, 2008

2

Oxygen Measurement via Phosphorescence: Reaction of Sodium Dithionite with Dissolved Oxygen

Tao, Zhimin, Goodisman, Jerry, Souid, Abdul-Kader

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 236 KB

english, 2008

3

Proton Dynamics in the Strong Chelate Hydrogen Bond of Crystalline Picolinic Acid N -Oxide. A New Computational Approach and Infrared, Raman and INS Study

Stare, Jernej, Panek, Jarosław, Eckert, Juergen, Grdadolnik, Jože, Mavri, Janez, Hadži, Dušan

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 460 KB

english, 2008

4

Electrochemical Oxidation of 2-Pyrimidinethiols and Theoretical Study of Their Dimers, Disulfides, Sulfenyl Radicals, and Tautomers

Freeman, Fillmore, Po, Henry N., Ho, Thach S., Wang, Ximeng

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 734 KB

english, 2008

5

Theoretical Studies for Lewis Acid−Base Interactions and C−H···O Weak Hydrogen Bonding in Various CO 2 Complexes

Kim, Kyung Hyun, Kim, Yongho

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 283 KB

english, 2008

6

Nuclear Quadrupole Moment of 119 Sn

Barone, Giampaolo, Mastalerz, Remigius, Reiher, Markus, Lindh, Roland

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 144 KB

english, 2008

7

Anion−π and π−π Cooperative Interactions Regulating the Self-Assembly of Nitrate−Triazine−Triazine Complexes

Zaccheddu, Maurizio, Filippi, Claudia, Buda, Francesco

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 185 KB

english, 2008

8

Effects of High Pressure on the Luminescence Spectra of Eu(SO 4 ) 2 ·NH 4 Microcrystals: Anisotropically Induced Structural Distortions

Cascales, Concepción, de Andrés, Alicia, Sánchez-Benitez, Javier

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 363 KB

english, 2008

9

Triethylsilanol: Molecular Conformations and Role of the Hydrogen-Bonding Oligomerization in Its Vibrational Spectra

Montejo, Manuel, Ureña, Francisco Partal, Márquez, Fernando, López González, Juan Jesús

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 139 KB

english, 2008

10

Raman Spectroscopy as a Probe of Temperature and Oxidation State for Gadolinium-Doped Ceria Used in Solid Oxide Fuel Cells

Maher, R. C., Cohen, L. F., Lohsoontorn, P., Brett, D. J. L., Brandon, N. P.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 92 KB

english, 2008

11

Computational Methods in Organic Chemistry. 3. Correction of Computed Enthalpies for Multiple Conformations

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 38 KB

english, 2008

12

Transition-State Spectroscopy of the Photoinduced Ca + CH 3 F Reaction. 3. Reaction Following the Local Excitation to Ca(4s3d 1 D)

Gloaguen, E., Sanz Sanz, C., Collier, M., Gaveau, M.-A., Soep, B., Roncero, O., Mestdagh, J.-M.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 402 KB

english, 2008

13

Molecular Dynamics Simulations of the Interactions between Platinum Clusters and Carbon Platelets

Sanz-Navarro, Carlos F., Åstrand, Per-Olof, Chen, De, Rønning, Magnus, van Duin, Adri C. T., Jacob, Timo, Goddard, William A.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 889 KB

english, 2008

14

Microwave Spectrum, Dipole Moment, and Internal Dynamics of the Methyl Fluoride−Carbonyl Sulfide Weakly Bound Complex

Serafin, Michal M., Peebles, Sean A.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 77 KB

english, 2008

15

Reactivity, Selectivity, and Aromaticity of Be 32- and Its Complexes

Roy, Debesh Ranjan, Chattaraj, Pratim Kumar

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 376 KB

english, 2008

16

Kinetics Study of the OH + Alkene → H 2 O + Alkenyl Reaction Class

Huynh, Lam K., Barriger, Kyle, Violi, Angela

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 273 KB

english, 2008

17

Identification of the Transition States in the Inversion of 1,4-Benzodiazepines with the Ab Initio Replica Path Method

Lee, Yong-Sok, Pike, Victor W., Hodoscek, Milan

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 357 KB

english, 2008

18

He I Photoelectron Spectra and Gas-Phase Electronic Structures of End-Functionalized [3]- and [5]-Ladderanes

Friščić, Tomislav, Klasinc, Leo, Kovač, Branka, MacGillivray, Leonard R.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 56 KB

english, 2008

19

Photodissociation and Spectroscopic Study of Cold Protonated Dipeptides

Fujihara, Akimasa, Matsumoto, Hiroyuki, Shibata, Yohei, Ishikawa, Haruki, Fuke, Kiyokazu

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 293 KB

english, 2008

20

Tunneling Splittings for “O···O Stretching” and Other Vibrations of Tropolone Isotopomers Observed in the Infrared Spectrum Below 800 cm -1

Redington, Richard L., Redington, Theresa E., Sams, Robert L.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 461 KB

english, 2008

21

Photodissociation Dynamics of Bromofluorobenzenes Using Velocity Imaging Technique

Tang, Ying, Lee, Wei-Bin, Zhang, Bing, Lin, King-Chuen

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 382 KB

english, 2008

22

Unraveling the Dynamics of the C( 3 P, 1 D) + C 2 H 2 Reactions by the Crossed Molecular Beam Scattering Technique †

Leonori, Francesca, Petrucci, Raffaele, Segoloni, Enrico, Bergeat, Astrid, Hickson, Kevin M., Balucani, Nadia, Casavecchia, Piergiorgio

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 373 KB

english, 2008

23

Absolute Rate Coefficient Determination and Reaction Mechanism Investigation for the Reaction of Cl Atoms with CH 2 I 2 and the Oxidation Mechanism of CH 2 I Radicals

Stefanopoulos, Vassileios G., Papadimitriou, Vassileios C., Lazarou, Yannis G., Papagiannakopoulos, Panos

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 152 KB

english, 2008

24

Half-Sandwich Structure of Cyclopentadienyl Dialuminum [Al 2 (η 5 -C 5 H 5 )] from Pulsed-Field Ionization Electron Spectroscopy and ab Initio Calculations

Lei, Yuxiu, Yang, Dong-Sheng

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 174 KB

english, 2008

25

Triplet State Dipole Moments of Aminobenzonitriles

Demeter, Attila, Zachariasse, Klaas A.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 64 KB

english, 2008

26

Influence of Electronic Resonances on Mode Selective Excitation with Tailored Laser Pulses

Konradi, J., Gaál, A., Scaria, A., Namboodiri, V., Materny, A.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 566 KB

english, 2008

27

Kinetics of Heterogeneous Reaction of CaCO 3 Particles with Gaseous HNO 3 over a Wide Range of Humidity

Liu, Y., Gibson,, Cain,, Wang, H., Grassian,, Laskin, A.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 245 KB

english, 2008

28

Electron-Transfer and Acid−Base Properties of a Two-Electron Oxidized Form of Quaterpyrrole that Acts as Both an Electron Donor and an Acceptor

Zhang, Min, E, Wenbo, Ohkubo, Kei, Sanchez-Garcia, David, Yoon, Dae-Wi, Sessler, Jonathan L., Fukuzumi, Shunichi, Kadish, Karl M.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 569 KB

english, 2008

29

Formation of Volatile Organic Compounds in the Heterogeneous Oxidation of Condensed-Phase Organic Films by Gas-Phase OH

Vlasenko, Alexander, George, Ingrid J., Abbatt, Jonathan P. D.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 203 KB

english, 2008

30

Reversible Intramolecular Triplet−Triplet Energy Transfer in Benzophenone- N -methylphthalimide Dyad

Sakamoto, Masanori, Kim, Sung Sik, Fujitsuka, Mamoru, Majima, Tetsuro

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 237 KB

english, 2008

31

MP2 Study of the Dual σ/π−Anion-Binding Affinity of Fluorinated Phthallic Acid Anhydrides

Estarellas, Carolina, Quiñonero, David, Frontera, Antonio, Ballester, Pablo, Morey, Jeroni, Costa, Antonio, Deyà, Pere M.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 256 KB

english, 2008

32

C−H Activation of Ethane by Group 4 Metal Atoms: Observation and Characterization of the MH−CH 2 CH 3 , MH 2 −(CH 2 ) 2 , and MH 3 −CHCH 2 Complexes

Cho, Han-Gook, Andrews, Lester

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 198 KB

english, 2008

33

Ab Initio and Experimental Studies of the Large-Amplitude Motion in BF 2 OH

Coudert, Laurent H., Garcia-Fernandez, Pablo, Mäder, Heinrich, Demaison, Jean, Boggs, James E.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 132 KB

english, 2008

34

Minimum Polarizability Principle Applied to Lowest Energy Isomers of Some Gaseous All-Metal Clusters

Mang, Chao-Yong, Zhao, Xia, He, Li-Xian, Liu, Cai-Ping, Wu, Ke-Chen

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 59 KB

english, 2008

35

OH-Initiated Oxidation of Toluene. 3. Low-Energy Routes to Cresol and Oxoheptadienal

Frankcombe, Terry J.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 55 KB

english, 2008

36

Observation of the Ã−X̃ Electronic Transition of the Isomers and Conformers of Pentyl Peroxy Radical Using Cavity Ringdown Spectroscopy

Sharp, Erin N., Rupper, Patrick, Miller, Terry A.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 282 KB

english, 2008

37

Computational Study on the Existence of Organic Peroxy Radical-Water Complexes (RO 2 ·H 2 O)

Clark, Jared, English, Alecia M., Hansen, Jaron C., Francisco, Joseph S.

Journal:

Journal of Physical Chemistry A

Year:

2008

Language:

english

File:

PDF, 475 KB

english, 2008

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