Chemical Physics Letters

Chemical Physics Letters, Vol.437, No.1-3 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (31 articles)

1 - 7	Approximate transferability in conjugated polyalkenes Eskandari K, Mandado M, Mosquera RA
8 - 13	Experimental and theoretical studies of the CCl+O-2 reaction Xiang TC, Liu KH, Shi CY, Su HM, Kong FN
14 - 16	CO2 sorption in activated carbon in the presence of water Sun Y, Wang YX, Zhang Y, Zhou YP, Zhou L
17 - 22	Ion-imaging study of C-60 fragmentation Climen B, Concina B, Lebeault MA, Lepine F, Baguenard B, Bordas C
23 - 27	Isotope effects in the infrared spectrum of the OCS dimer Afshari M, Abusara Z, Dehghani N, Moazzen-Ahmadi N, McKellar ARW
28 - 31	Photoinduced electron transfer of N,N,N',N'-tetramethyl-p-phenylenediamine and maleic anhydride in 2-propanol Hirata Y, Araki S
32 - 37	The molecular structure and dynamics of 2-aminopyridine-3-carboxylic acid by X-ray diffraction at 100 K, inelastic neutron scattering, infrared, Raman spectroscopy and from first principles calculations Pawlukojc A, Starosta W, Leciejewicz J, Natkaniec I, Nowak D
38 - 44	Inelastic neutron scattering and periodic DFT studies of crystalline aromatic materials: Azulene. A test of ab initio methods Verdal N, Rivera SA, Hudson BS
45 - 49	Electronic structures and hydrogen bond network of ambient water and amorphous ices He C, Lian JS, Jiang Q
50 - 55	Electron transfer and dissociation mechanism of ferrioxalate: A time resolved optical and EXAFS study Chen J, Zhang H, Tomov IV, Ding XL, Rentzepis PM
56 - 60	Anharmonic charge transfer vibronic states and luminescence dynamics of uranyl compounds Liu GK, Vikhnin VS
61 - 65	Single-crystal to single-crystal phase transition with a large deformation in Zn(OH)(2) under high-pressure Kusaba K, Yagi T, Yamaura J, Miyajima N, Kikegawa T
66 - 72	A fully quantum mechanical simulation study on the lowest n-pi(*) state of hydrated formaldehyde Mochizuki Y, Komeiji Y, Ishikawa T, Nakano T, Yamataka H
73 - 78	Modelling STM images of TiO2(110) from first-principles: Defects, water adsorption and dissociation products Teobaldi G, Hofer WA, Bikondoa O, Pang CL, Cabailh G, Thornton G
79 - 82	Ab initio study of 2,3,7,8-tetrachlorinated dibenzo-p-dioxin adsorption on single wall carbon nanotubes Fagan SB, Santos EJG, Souza AG, Mendes J, Fazzio A
83 - 86	Spin-polarized electron current from carbon-doped open armchair boron nitride nanotubes: Implication for nano-spintronic devices Zhou G, Duan WH
87 - 91	Boron mediated synthesis of multiwalled carbon nanotubes by chemical vapor deposition Mondal KC, Coville NJ, Witcomb MJ, Tejral G, Havel J
92 - 98	Environment dependent dynamic charge potential for silica: Application to nanoscale silica structures Muralidharan K, Cao C, Wan YX, Runge K, Cheng HP
99 - 103	The functionalization of (5,5), (9,0), and (10,0) single wall carbon nanotubes by CHn fragments Rosi M, Bauschlicher CW
104 - 107	Excitons in bundles of single walled carbon nanotubes Zamkov M, Alnaser A, Chang Z, Richard P
108 - 111	Monte Carlo studies on the filling process of carbon nanotubes with nickel Li HY, Ren XB, Guo XY
112 - 116	Physical basis for characterizing native structures of proteins Harano Y, Roth R, Sugita Y, Ikeguchi M, Kinoshita M
117 - 119	Charge transfer between the PO4- of DNA and the arginine(+) and lysine(+) side chains of proteins Bende A, Bogar F, Ladik J
120 - 125	High-resolution two-dimensional NMR spectra of half-integer-spin quadrupolar nuclei from one-dimensional projections Vosegaard T, Massiot D
126 - 131	Spin Sorting: Apparent longitudinal relaxation without spin transitions Chang YLV, Haywood SE, Woods JC, Conradi MS
132 - 137	Phase-space Fisher information Hornyak I, Nagy A
138 - 142	The ONIOM molecular dynamics method for biochemical applications: Cytidine deaminase Matsubara T, Dupuis M, Aida M
143 - 147	Periodic calcium waves in coupled cells induced by internal noise Perc M, Gosak M, Marhl M
148 - 152	An efficient statistically converged average configuration for solvent effects Coutinho K, Georg HC, Fonseca TL, Ludwig V, Canuto S
153 - 158	Resonance Raman spectroscopic and density functional theory study of p-nitroacetophenone (PNAP) Pei KM, Ma YF, Zheng XM, Li HY
159 - 163	Analytical RISM-MP2 free energy gradient method: Application to the Schlenk equilibrium of Grignard reagent Mori T, Kato S