Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.121, No.49 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (15 articles)

9409 - 9414	Electromechanical Properties of Ba(1-x)SrxTiO3 Perovskite Solid Solutions from First-Principles Calculations Rusevich LL, Zvejnieks G, Erba A, Dovesi R, Kotomin EA
9415 - 9420	Does the Cl + CH4 -> H + CH3Cl Reaction Proceed via Walden Inversion? Krotos L, Czako G
9421 - 9428	H-X (X = H, CH3, CH2F, CHF2, CF3, and SiH3) Bond Activation by Criegee Intermediates: A Theoretical Perspective Kumar M, Francisco JS
9429 - 9434	Coordination Structure and Fragmentation Chemistry of the Tripositive Lanthanide-Thio-Diglycolamide Complexes Chen XT, Li QN, Gong Y
9435 - 9445	2D-IR Spectroscopy of an AHA Labeled Photoswitchable PDZ2 Domain Stucki-Buchli B, Johnson PJM, Bozovic O, Zanobini C, Koziol KL, Hamm P, Gulzar A, Wolf S, Buchenberg S, Stock G
9446 - 9457	Bond Dissociation Energies of Tungsten Molecules: WC, WSi, WS, WSe, and WCl Sevy A, Huffaker RF, Morse MD
9458 - 9465	Dynamics of Radical Ions of Hydroxyhexafluoroisopropyl-Substituted Benzenes Okamoto K, Nomura N, Fujiyoshi R, Umegaki K, Yamamoto H, Kobayashi K, Kozawa T
9466 - 9473	Sequential Capture of O(P-3) and HCN by Helium Nanodroplets: Infrared Spectroscopy and ab Initio Computations of the (3)Sigma O-HCN Complex Brice JT, Franke PR, Douberly GE
9474 - 9484	Experimental and Computational Thermochemical Study of Maleic Anhydride and Vinylene Carbonate Sousa C, Matos MAR, Morais VMF
9485 - 9494	Molecular Dynamics Study of the Collision-Induced Reaction of H with CO on Small Water Clusters Korchagina KA, Spiegelman F, Cuny J
9495 - 9507	Dispersion Interactions in QM/EFP Slipchenko LV, Gordon MS, Ruedenberg K
9508 - 9517	Computational and Experimental Study of Thermodynamics of the Reaction of Titania and Water at High Temperatures Nguyen QN, Bauschlicher CW, Myers DL, Jacobson NS, Opila EJ
9518 - 9530	Lennard-Jones Potentials for the Interaction of CO2 with Five-Membered Aromatic Heterocycles Vidal-Vidal A, Lopez CS, Faza ON
9531 - 9543	Insights into the Mechanism of Ground and Excited State Double Proton Transfer Reaction in Formic Acid Dimer Giri S, Parida R, Jana M, Gutierrez-Oliva S, Toro-Labbe A
9544 - 9556	Systematic Coupled Cluster Study of Noncovalent Interactions Involving Halogens, Chalcogens, and Pnicogens Oliveira V, Kraka E