Chemical Physics Letters

Chemical Physics Letters, Vol.401, No.1-3 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (57 articles)

1 - 6	Monte Carlo simulations of flexible molecules in a static electric field: electric dipole and conformation Poulain P, Antoine R, Broyer M, Dugourd P
7 - 12	Validation of a computational scheme to study N-15 and C-13 nuclear shielding constants Mothana B, Ban FQ, Boyd RJ
13 - 18	Solubility of Mo6S4.5I4.5 nanowires Nicolosi V, Vrbanic D, Mrzel A, McCauley J, O'Flaherty S, Mihailovic D, Blau WJ, Coleman JN
19 - 23	Synthesis and characterization of monodisperse silica colloids loaded with superparamagnetic iron oxide nanoparticles Im SH, Herricks T, Lee YT, Xia YN
24 - 29	Homology models of main proteinase from coronavirus associated with SARS Liu HL, Lin JC, Ho Y, Chen CW
30 - 34	Phosphorescence of individual horseradish peroxidases proteins having a modified heme group Mei EW, Gao F, Vinogradov S, Vanderkooi JM, Hochstrasser RM
35 - 39	Fast computation algorithm for finding stable molecular structures using network-connected computers Okuno Y, Mashiko S
40 - 46	Interplay between pi-pi interactions and the H-bonding ability of aromatic nitrogen bases Mignon P, Loverix S, Geerlings P
47 - 51	Spin-polarized electron current from Mn-doped closed zigzag GaN nanotubes Hao SG, Zhou G, Wu H, Duan WH, Gu BL
52 - 57	Photo-dynamics on thin silver films Jacobson ML, Rowlen KL
58 - 61	Calculation of the enthalpies of formation for transition metal complexes Cundari TR, Leza HAR, Grimes T, Steyl G, Waters A, Wilson AK
62 - 67	OD ESR detection of the radical anions of cyclic nitrones in liquid solutions Barlukova MM, Gritsan NP, Bagryansky VA, Starichenko VF, Grigor'ev IA, Molin YN
68 - 71	Relativistic density functional theory study on the structure and bonding of U(IV) and Np(IV) hydrates Tsushima S, Yang TX
72 - 75	A partition experimental evidence of molecular complex formation of some quinones with sodium dodecyl sulphate anion in aqueous phase by spectrophotometric method Ray AK, Saha A, Mukherjee AK
76 - 79	Entropic evidence for cooperation of multiple instabilities upon a metal-insulator transition in (EDO-TTF)(2)PF6 Saito K, Ikeuchi S, Ota A, Yamochi H, Saito G
80 - 84	The outer valence orbital momentum profiles of thiophene by electron momentum spectroscopy Zhang SF, Ren XG, Su GL, Ning CG, Zhou H, Li B, Huang F, Li GQ, Deng JK
85 - 88	Solvated electron in (H2O)(-)(20) dodecahedral cavity: calculated stretch frequencies and vertical dissociation energy Khan A
89 - 93	Electronic spectra of intermediate charge transfer complexes of OVCl3 in argon matrices Goldberg N, Ault BS
94 - 98	Binary adsorption equilibrium of propylene and ethylene on silicalite-1: prediction and experiment Peng J, Ban HY, Zhang XT, Song LJ, Sun ZL
99 - 103	Influence of C5-methylation of cytosine on the formation of cyclobutane pyrimidine dimers Li XY, Eriksson LA
104 - 108	The surface sites of sulfated zirconia studied in situ by laser-induced fluorescence spectroscopy Chen J, Feng ZC, Shi JY, Ying PL, Zhang HD, Li C
109 - 114	Hydrogen-bonding interactions between 1-methylindole and alcohols Munoz MA, Galan M, Carmona C, Balon M
115 - 121	Dynamic alignment of CH3I by strong picosecond laser pulses Kaziannis S, Siozos P, Kosmidis C
122 - 129	Excited states of pigments in photosystem II reaction centers of photosynthesis: Characterization into a central dimer and remaining monomers Saito K, Mukai K, Sumi H
130 - 134	On the magnetic susceptibility of polyaniline - an alternative approach Petr A, Neudeck A, Dunsch L
135 - 139	On line shape measurement and simulation of rovibrational transitions of water vapour in the near infrared region Bandyopadhyay A, Ray A, Ray B, Ghosh PN
140 - 148	Model studies of spectral and photophysical characteristics of donor-acceptor-polyenes: dimethylamino-cyano-diphenylbutadiene El-Gezawy H, Rettig W, Lapouyade R
149 - 156	A joint theoretical and experimental study of phenylene-acetylene molecular wires Magyar RJ, Tretiak S, Gao Y, Wang HL, Shreve AP
157 - 163	Excited state dynamics of a PYP chromophore model system explored with ultrafast infrared spectroscopy Usman A, Mohammed OF, Heyne K, Dreyer J, Nibbering ETJ
164 - 169	Ring-current signatures in shielding-density maps Soncini A, Fowler PW, Lazzeretti P, Zanasi R
170 - 174	Fundamental absorption frequency from quasi-classical direct ab initio molecular dynamics: diatomic molecule Aida M, Dupuis M
175 - 179	Memory effects in Brownian dynamics simulations of ion transport Bastug T, Kuyucak S
180 - 184	Frequency stabilization of tunable infrared diode lasers for time-resolved monitoring of transient species Hanoune B, Lemoine B
185 - 188	pH dependent binding of chlorin-p6 with phosphatidyl choline liposomes Das K, Jain B, Dube A, Gupta PK
189 - 195	The asymmetric nature of charge transfer states of the cyano-substituted proton sponge Szemik-Hojniak A, Deperasinska I, Buma WJ, Balkowski G, Pozharskii AF, Vistorobskii NV, Allonas X
196 - 199	A 2D graphical representation of DNA sequence Liao B
200 - 204	Hydrogen-bonding and protonation effects on the formation of charge transfer complex between para-benzoquinone and 2,6-dimethoxy phenol Bangal PR
205 - 210	Computational methods for protein design and protein sequence variability: biased Monte Carlo and replica exchange Yang X, Saven JG
211 - 216	Examining the transition metal hydrosulfides: the pure rotational spectrum of CuSH ((X)over-tilde(1)A') Janczyk A, Walter SK, Ziurys LM
217 - 222	Molecular dynamics simulation of lithium iodide in liquid dimethylsulfoxide Onthong U, Megyes T, Bako I, Radnai T, Hermansson K, Probst M
223 - 226	High resolution X-ray photoemission of SrCu2O2 Lynch CCB, Egdell RG, Law DSL
227 - 231	Electron attachment to monomeric and dimeric forms of glycolaldehyde Ptasinska S, Limao-Vieira P, Denifl S, Scheier P, Mark TD
232 - 240	DFT study of small bimetallic palladium-copper clusters Efremenko I, Sheintuch M
241 - 245	Visible photon cascade emission from the high energy levels of Er3+ Peijzel PS, Meijerink A
246 - 253	A combined experimental and theoretical study of the conformation of N,N'-diphenyl-N,N'-di(m-tolyl)benzidine using solid-state N-15 NMR and DFT calculations Kaji H, Yamada T, Tsukamoto N, Horii F
254 - 258	Evidence of a shift between one- and two-photon processes associated with benzene trapped in helium nanodroplets Curtis S, Boatwright A, Wright RR, Stace AJ
259 - 265	The rotational spectrum of the 3,3-dimethyloxetane center dot center dot center dot hydrogen chloride complex Sanchez R, Blanco S, Lesarri A, Lopez JC, Alonso JL
266 - 270	Photoelectron spectroscopy of titanium-benzene cluster anions Zheng WJ, Nilles JM, Thomas OC, Bowen KH
271 - 275	The study of deposited silver particulate films by simple method for efficient SERS Fang JH, Zhong CG, Mu RW
276 - 281	Semiempirical molecular dynamics investigation of the excited state lifetime of ethylene Barbatti M, Granucci G, Persico M, Lischka H
282 - 287	The ring-current model of the paratropic pentalene molecule Cuesta IG, Ligabue A, de Meras AS, Lazzeretti P
288 - 295	First-principles calculations on the role of CN precursors for the formation of fullerene-like carbon nitride Gueorguiev GK, Neidhardt J, Stafstrom S, Hultman L
296 - 301	A semi-phenomenological approach to the transport and diffusion of small spherical macromolecules in solution Uvarov A, Fritzsche S
302 - 306	Spectroscopic characterisation of crystal violet inclusion complexes in beta-cyclodextrin Garcia-Rio L, Godoy A, Leis JR
307 - 311	Internal noise stochastic resonance of synthetic gene network Wang ZW, Hou ZH, Xin HW
312 - 317	AMBER-based hybrid force field for conformational sampling of polypeptides Kamiya N, Watanabe YS, Ono S, Higo J
318 - 322	Theoretical study of chemical compounds formed by insertion of rare gas atoms into glycine molecule: a step towards bio-rare gas chemistry? Chaban GM