Journal of Chemical Physics

Journal of Chemical Physics, Vol.118, No.1 Entire volume, number list

ISSN: 0021-9606 (Print)

In this Issue (54 articles)

1 - 3	Proton tunneling in fatty acid/soap crystals? Saitta AM, Klein ML
4 - 7	Low temperature electronic transport and electron transfer through organic macromolecules Zimbovskaya N
8 - 11	Vibronic spectrum of the Ag(NH3)(2) complex Miyawaki J, Djafari S, Sugawara K, Takeo H
12 - 16	Unusual excitation intensity dependence of fluorescence of CdTe nanoparticles Wu FX, Lewis JW, Kliger DS, Zhang JZ
17 - 28	Semiclassically optimized complex absorbing potentials of polynomial form. I. Pure imaginary case Poirier B, Carrington T
29 - 39	Spin exchange interactions of a spin dimer: Analysis of broken-symmetry spin states in terms of the eigenstates of Heisenberg and Ising spin Hamiltonians Dai DD, Whangbo MH
40 - 45	Hyperfine coupling tensors for multi-configurational quasi-degenerate perturbation theory Pak MV, Gordon MS
46 - 61	Wave packet interferometry for short-time electronic energy transfer: Multidimensional optical spectroscopy in the time domain Cina JA, Kilin DS, Humble TS
62 - 69	Dissociative photoionization of CH2Cl2 and enthalpy of formation of CHCl+: Experiments and calculations Chiang SY, Bahou M, Sankaran K, Lee YP, Lu HF, Su MD
70 - 74	Collisional deexcitation of the excited rare gas atoms in resonant states: The Watanabe-Katsuura theory revisited Fukuzawa H, Murata M, Kiyoto N, Mukai T, Fukuchi Y, Khadka DB, Ukai M, Odagiri T, Kameta K, Kouchi N, Hatano Y
75 - 82	A comparative study of elastic scattering of low-energy electrons by boron, aluminum and gallium trihalides da Costa RF, Ferreira LG, Lima MAP, Bettega MHF
83 - 86	A theoretical prediction on intermolecular monoelectron dihydrogen bond H center dot e center dot H in the cluster anion (FH)(2){e}(HF)(2) Hao XY, Li ZR, Wu D, Wang Y, Li ZS, Sun CC
87 - 92	Magnetic field quenching of individual rotational levels of the (A)over-tilde (1)A(u), 2v(3)(') state of acetylene Makarov VI, Quinones E
93 - 103	Collisionally enhanced isotopic selectivity in multiphoton dissociation of vibrationally excited CF3H Boyarkin OV, Kowalczyk M, Rizzo TR
104 - 112	Ab initio study of the spectroscopy of AgI: A complete active space self-consistent field plus averaged coupled pair functional approach to the lowest excited states Ramirez-Solis A
113 - 120	Laser spectroscopy of free pentacene molecules (II): Stark effect of the vibrationless S-1 <- S-0 transition Heinecke E, Hartmann D, Hese A
121 - 129	Lifetime measurements and quantum-defect theory treatment of the k (3)Pi(-)(u) state of hydrogen molecule Kiyoshima T, Sato S, Pazyuk EA, Stolyarov AV, Child MS
130 - 141	Electronic structure and spectroscopic properties of electronic states of VC2, VC2-, and VC2+ Majumdar D, Roszak S, Balasubramanian K
142 - 148	Theoretical study of the low-lying electronic states of ruthenium trimer (Ru-3) Guo R, Balasubramanian K
149 - 163	Unimolecular decay pathways of state-selected CO2+ in the internal energy range of 5.2-6.2 eV: An experimental and theoretical study Liu JB, Chen WW, Hochlaf M, Qian XM, Chang C, Ng CY
164 - 171	Ultrafast transient dynamics of Zn(II) porphyrins: Observation of vibrational coherence by controlling chirp of femtosecond pulses Yoon MC, Jeong DH, Cho S, Kim D, Rhee H, Joo T
172 - 178	Temperature dependence of the viscosity of nonpolymeric liquids Hsu JP, Lin SH
179 - 191	Crossover from nonadiabatic to adiabatic electron transfer reactions: Multilevel blocking Monte Carlo simulations Muhlbacher L, Egger R
192 - 201	Spin relaxation of radicals in low and zero magnetic field Fedin MV, Purtov PA, Bagryanskaya EG
202 - 208	Collective dynamics of liquid HCl: The density-density and longitudinal current correlations Balucani U, Pasqualini D, Garberoglio G, Vallauri R, Sutmann G
209 - 220	Extended rotational diffusion and dielectric relaxation of symmetrical top molecules in a dc electric field Titov SV, Kalmykov YP, Coffey WT
221 - 234	Development of a simple, self-consistent polarizable model for liquid water Yu HB, Hansson T, van Gunsteren WF
235 - 241	Water structure in supercritical mixtures of water and rare gases Botti A, Bruni F, Isopo A, Modesti G, Oliva C, Ricci MA, Senesi R, Soper AK
242 - 248	Stability of ice XII relative to ice V and ice VI at high pressures Johari GP
249 - 254	Instabilities in a spatially correlated autocatalytic chemical system Chakrabarti J
255 - 263	Geometry optimization of molecules in solution: Joint use of the mean field approximation and the free-energy gradient method Galvan IF, Sanchez ML, Martin ME, del Valle FJO, Aguilar MA
264 - 272	Vibrational spectroscopy of HOD in liquid D2O. III. Spectral diffusion, and hydrogen-bonding and rotational dynamics Lawrence CP, Skinner JL
273 - 278	Structure of molten 1,3-dimethylimidazolium chloride using neutron diffraction Hardacre C, Holbrey JD, McMath SEJ, Bowron DT, Soper AK
279 - 290	Solvation structure, thermodynamics, and conformational dependence of alanine dipeptide in aqueous solution analyzed with reference interaction site model theory Cui QZ, Smith VH
291 - 303	The role of different reorganization energies within the Zusman theory of electron transfer Casado-Pascual J, Morillo M, Goychuk I, Hanggi P
304 - 310	Free energy determination of phase coexistence in model C-60: A comprehensive Monte Carlo study Costa D, Pellicane G, Abramo MC, Caccamo C
311 - 316	High frequency acoustic modes in vitreous beryllium fluoride probed by inelastic x-ray scattering Scopigno T, Yannopoulos SN, Kastrissios DT, Monaco G, Pontecorvo E, Ruocco G, Sette F
317 - 320	Assignment of the complex vibrational spectra of the hydrogenated ZnO polar surfaces using QM/MM embedding French SA, Sokol AA, Bromley ST, Catlow CRA, Rogers SC, Sherwood P
321 - 328	Oxygen atom interactions with fused silica surfaces: D-1 and P-3 state-resolved energy transfer dynamics Buntin SA, Litorja M
329 - 336	Computer modeling of the liquid-vapor interface of an associating Lennard-Jones fluid Alejandre J, Duda Y, Sokolowski S
337 - 339	Two regimes of thermal resistance at a liquid-solid interface Xue L, Keblinski P, Phillpot SR, Choi SUS, Eastman JA
340 - 353	Phase transitions in systems small enough to be clusters Reguera D, Bowles RK, Djikaev Y, Reiss H
354 - 363	Time-dependent laminar electrokinetic slip flow in infinitely extended rectangular microchannels Yang J, Kwok DY
364 - 372	The deposition angle-dependent density of amorphous solid water films Dohnalek Z, Kimmel GA, Ayotte P, Smith RS, Kay BD
373 - 388	Analytic ab initio determination of the elastic modulus in stereoregular polymers: Analytical integral derivatives, long-range effects, implementation, and examples Jacquemin D, Andre JM, Champagne B
389 - 397	Supramolecular structure of helical ribbons self-assembled from a beta-sheet peptide Hwang WM, Marini DM, Kamm RD, Zhang SQ
398 - 406	Effects of sizes of charged species on the flocculation of biocolloids: Absorption of cations in membrane layer Kuo YC
407 - 413	Liquid-liquid phase separation in solutions of living semiflexible polymers Rane SS
414 - 424	Theory of intrapolymer excimer-formation kinetics Sung JY, Lee J, Lee S
425 - 433	Gibbs ensemble simulation of symmetric mixtures composed by the homopolymers AA, BB and their common block copolymer AB Poncela A, Rubio AM, Freire JJ
434 - 443	Studies on energy transfer in dendrimer supermolecule using classical random walk model and Eyring model Rana D, Gangopadhyay G
444 - 451	Growth algorithms for lattice heteropolymers at low temperatures Hsu HP, Mehra V, Nadler W, Grassberger P
452 - 453	An interpretation of the low-frequency spectrum of liquid water Padro JA, Marti J
454 - 455	Statistics of transitions in single molecule kinetics Gopich IV, Szabo A