Journal of Physical Chemistry A

Journal of Physical Chemistry A, Vol.112, No.2 Entire volume, number list

ISSN: 1089-5639 (Print)

In this Issue (23 articles)

161 - 165	Lewis acid-base interactions in weakly bound formaldehyde complexes with CO2, HCN, and FCN: Considerations on the cooperative H-bonding effects Rivelino R
166 - 171	Microwave catalysis through rotationally hot reactive species Bren U, Krzan A, Mavri J
172 - 175	Observation of entropic effect on conformation changes of complex systems under well-controlled temperature conditions Wang XB, Yang J, Wang LS
176 - 182	Magnetic isotope effect on kinetic parameters and quantum beats of radical pairs in micellar solution studied by optically detected ESR using pulsed microwave Kitahama Y, Sakaguchi Y
183 - 193	Difficulties in building radiation-generated three-spin systems using spin-labeled luminophores Matveeva AG, Sviridenko FB, Korolev VV, Kuibida LV, Stass DV, Shundrin LA, Reznikov VA, Grampp GG
194 - 198	A theoretical study of the photochemical isomerization reactions of furans from the triplet state Su MD
199 - 209	Photoisomerization of cis,cis- to trans,trans-1,4-diaryl-1,3-butadienes in the solid state: The bicycle-pedal mechanism Saltiel J, Krishna TSR, Laohhasurayotin S, Fort K, Clark RJ
210 - 214	Ultrafast ring-closure reaction of photochromic indolylfulgimides studied with UV-pump - IR-probe spectroscopy Koller FO, Schreier WJ, Schrader TE, Malkmus S, Schulz C, Dietrich S, Ruck-Braun K, Braun M
215 - 223	Torsion-vibration coupling in methanol: Diabatic behavior in the CH overtone region Perry DS
224 - 231	The benzophenone S-1(n,pi) -> T-1(n,pi) states intersystem crossing reinvestigated by ultrafast absorption spectroscopy and multivariate curve resolution Aloise S, Ruckebusch C, Blanchet L, Rehault J, Buntinx G, Huvenne JP
232 - 237	Intra- and intermolecular hydrogen bonds in alkyl and silyl ethers: Experimental and theoretical analysis Dias LC, Ferreira MAB, Tormena CF
238 - 248	Thioperoxy derivative generated by UV-induced transformation of N-hydroxypyridine-2(1H)-thione isolated in low-temperature matrixes Lapinski L, Gerega A, Sobolewski AL, Nowak MJ
249 - 255	Approach to the atmospheric chemistry of methyl nitrate and methylperoxy nitrite. Chemical mechanisms of their formation and decomposition reactions in the gas phase Arenas JF, Avila FJ, Otero JC, Pelaez D, Soto J
256 - 267	Theoretical study of hydrated copper(II) interactions with guanine: A computational density functional theory study Pavelka M, Shukla MK, Leszczynski J, Burda JV
268 - 280	General methodology to optimize damping functions to account for charge penetration effects in electrostatic calculations using multicentered multipolar expansions Werneck AS, Filho TMR, Dardenne LE
281 - 295	Detection and evaluation of hydrogen bond strength in nucleic acid base pairs Mohajeri A, Nobandegani FF
296 - 304	Structural, electronic, and magnetic properties of Co-n(benzene)(m) complexes Zhang XY, Wang JL
305 - 311	Structure, spectroscopy, and reactivity properties of porphyrin pincers: A conceptual density functional theory and time-dependent density functional theory study Huang Y, Zhong AG, Rong CY, Xiao XM, Liu SB
312 - 321	Intramolecular hydrogen bonding and cooperative interactions in carbohydrates via the molecular tailoring approach Deshmukh MM, Bartolotti LJ, Gadre SR
322 - 331	Synthesis, characterization, and ab initio theoretical study of a molecularly imprinted polymer selective for biosensor materials Jacob R, Tate M, Banti Y, Rix C, Mainwaring DE
332 - 335	Electronic ground state of higher acenes Jiang DE, Dai S
336 - 341	An ab initio and density functional theory study of the structure and bonding of sulfur ylides Standard JM, Copack BA, Johnson TK, Przybyla DE, Graham SR, Steidl RJ
342 - 346	Absolute proton affinity for acetaldehyde Traeger JC