화학공학소재연구정보센터

Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.114, No.17 Entire volume, number list
ISSN: 1089-5639 (Print) 

In this Issue (22 articles)

5439 - 5444 Effect of Electron-Electron Interactions on the Charge Carrier Transitions in trans-Polyacetylene
Ma HB, Schollwock U
5445 - 5452 Closed-Cage Tungsten Oxide Clusters in the Gas Phase
Singh DMDJ, Pradeep T, Thirumoorthy K, Balasubramanian K
5453 - 5461 D-Atom Products in Predissociation of CD2CD2OH from the 202-215 nm Photodissociation of 2-Bromoethanol
Edwards LW, Ryazanov M, Reisler H, Klippenstein SJ
5462 - 5467 Motion Analysis of Self-Propelled Pt-Silica Particles in Hydrogen Peroxide Solutions
Ke H, Ye SR, Carroll RL, Showalter K
5468 - 5477 Theoretical Study of the Addition of OH Radicals to trans-Geraniol-(3,7-dimethylocta-2, 6-dien-1-ol), 6-Methyl-5-hepten-2-one, and 6-Hydroxy-4-methyl-4-hexenal
Leonardo T, Baptista L, da Silva EC, Arbilla G
5478 - 5484 Ab Initio Chemical Kinetics of Methyl Formate Decomposition: The Simplest Model Biodiesel
Metcalfe WK, Simmie JM, Curran HJ
5485 - 5492 ReaxFF Reactive Force Field Development and Applications for Molecular Dynamics Simulations of Ammonia Borane Dehydrogenation and Combustion
Weismiller MR, van Duin ACT, Lee J, Yetter RA
5493 - 5502 Shock Tube Study on the Thermal Decomposition of CH3OH
Lu KW, Matsui H, Huang CL, Raghunath P, Wang NS, Lin MC
5503 - 5508 Q((n)) Species Distribution in K2O center dot 2SiO(2) Glass by Si-29 Magic Angle Flipping NMR
Davis MC, Kaseman DC, Parvani SM, Sanders KJ, Grandinetti PJ, Massiot D, Florian P
5509 - 5514 Laser-Induced Fluorescence of Rhodamine 6G Cations in the Gas Phase: A Lower Bound to the Lifetime of the First Triplet State
Kordel M, Schooss D, Neiss C, Walter L, Kappes MM
5515 - 5519 Quantifying Resonant Raman Cross Sections with SERS
Meyer SA, Le Ru EC, Etchegoin PG
5520 - 5525 Experimental Study of the Rate of OH + HO2 -> H2O + O-2 at High Temperatures Using the Reverse Reaction
Hong ZK, Vasu SS, Davidson DF, Hanson RK
5526 - 5536 Conformational Space and Photochemistry of alpha-Terpinene
Marzec KM, Reva I, Fausto R, Malek K, Proniewicz LM
5537 - 5543 Microwave Spectrum and Intramolecular Hydrogen Bonding of Propargyl Selenol (HC CCH2SeH)
Mullendal H, Konoyalov A, Guillemin JC
5544 - 5550 Spectroscopic and Theoretical Investigations on Effective and Selective Interaction of Fullerenes C-60 and C-70 with a Derivatized Zn-phthalocyanine: Stabilization of Charge-Recombined State by Side-On Approach of C-70
Ray A, Santhosh K, Chattopadhyay S, Samanta A, Bhattacharya S
5551 - 5557 Selective Homonuclear Decoupling in H-1 NMR: Application to Visualization of Enantiomers in Chiral Aligning Medium and Simplified Analyses of Spectra in Isotropic Solutions
Prabhu UR, Suryaprakash N
5558 - 5564 Hydrogen Abstraction from n-Butanol by the Hydroxyl Radical: High Level Ab Initio Study of the Relative Significance of Various Abstraction Channels and the Role of Weakly Bound Intermediates
Moc J, Simmie JM
5565 - 5572 Substitution Effects of Diborane on the Interaction with Borazine (Inorganic Benzene)
Ravinder P, Subramanian V
5573 - 5579 Fast Reactions of Hydroxycarbenes: Tunneling Effect versus Bimolecular Processes
Kiselev VG, Swinnen S, Nguyen VS, Gritsan NP, Nguyen MT
5580 - 5587 Theoretical Investigation on the Effect of Protonation on the Absorption and Emission Spectra of Two Amine-Group-Bearing, Red "Push-Pull" Emitters, 4-Dimethylamino-4'-nitrostilbene and 4-(dicyanomethylene)-2-methyl-6-p-(dimethylamino) styryl-4H-pyran, by DFT and TDDFT Calculations
Petsalakis ID, Georgiadou DG, Vasilopoulou M, Pistolis G, Dimotikali D, Argitis P, Theodorakopoulos G
5588 - 5595 Positive Identification of UV-Generated, Non-Hydrogen-Bonded Isomers of o-Hydroxybenzaldehyde and o-Hydroxyacetophenone
Lapinski L, Rostkowska H, Reva I, Fausto R, Nowak MJ
5596 - 5600 Nanoparticle Shape Evolution Identified through Multivariate Statistics
Huitink D, Kundu S, Park C, Mallick B, Huang JZ, Liang H