Chemical Physics Letters

Chemical Physics Letters, Vol.467, No.4-6 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (44 articles)

217 - 222	Simple Hofmeister series Lyklema J
223 - 229	Electronic structure of Bi3Gay(-) semiconductor clusters and the special stability of Bi3Ga2- - A gas phase Zintl analogue Gupta U, Reveles JU, Melko JJ, Khanna SN, Castleman AW
230 - 232	High-level ab-initio calculation of gas-phase NMR chemical shifts and secondary isotope effects of methanol Auer AA
233 - 236	Cavity ring-down spectroscopy of singlet oxygen generated in microwave plasma Foldes T, Cermak P, Macko M, Veis P, Macko P
237 - 242	Ab initio interaction potential of methane and nitrogen Shadman M, Yeganegi S, Ziaie F
243 - 248	Theoretical study of the dynamics of H plus alkane reactions Layfield JP, Troya D
249 - 254	Theoretical study of cocaine and ecgonine methyl ester in gas phase and in aqueous solution Rincon DA, Cordeiro MNDS, Mosquera RA, Borges F
255 - 259	IR-UV double resonance spectra of pyrazine dimers: Competition between CH center dot center dot center dot pi, pi center dot center dot center dot pi and CH center dot center dot center dot N interactions Busker M, Svartsov YN, Haber T, Kleinermanns K
260 - 264	Evidence for a non-Rydberg molecular doubly excited state of Ca-2 Gaveau MA, Mestdagh JM, Bouissou T, Durand G, Heitz MC, Spiegelman F
265 - 269	Theoretical characters of the ground states of YbX (X = F, Cl, Br, I, At) Su T, Yang CL, Wang XQ, Bai FJ, Wang MS
270 - 275	Quantum sieving in organic frameworks Garberoglio G
276 - 280	The role of accurate quantum mechanical computations in the assignment of vibrational spectra for unstable free radicals: H2CN and F2CN as test cases Puzzarini C, Barone V
281 - 286	The ejection anisotropy in the Coulomb explosion of some alkyl halide molecules under strong ps laser fields Kaziannis S, Kosmidis C
287 - 293	Density functional study of aqueous uranyl(VI) fluoride complexes Buhl M, Sieffert N, Wipff G
294 - 298	Local MP2 periodic study of rare-gas crystals Halo M, Casassa S, Maschio L, Pisani C
299 - 303	Stability of growth rate of sodium chlorate Mitrovic MM, Zekic AA, Baros ZZ
304 - 308	Effect of finite pulse duration in three pulse photon echo experiments: Numerical comparison of 3PEPS and S3PE Yang M
309 - 312	Terahertz optical properties of the high explosive beta-HMX Hooper J, Mitchell E, Konek C, Wilkinson J
313 - 317	Effect of oxygen content on structural and transport properties in SrTiO3-x thin films Cai HL, Wu XS, Gao J
318 - 322	The predictions of the critical point parameters for Al, Cu and W found from the correspondence between the critical point and unit compressibility line (Zeno line) positions Apfelbaum EM, Vorob'ev S
323 - 326	Local-field correction for intra-4f-configurational transitions of rare earth ions embedded in amorphous chalcogenide solids Choi YG, Song JH
327 - 330	High-aspect-ratio gold nanorods synthesized in a surfactant gel phase Takenaka Y, Kitahata H
331 - 334	Growth kinetics of silicon nanowires by platinum assisted vapour-liquid-solid mechanism Jeong H, Park TE, Seong HK, Kim M, Kim U, Choi HJ
335 - 338	Hyper-Rayleigh scattering from BaTiO3 and PbTiO3 nanocrystals Rodriguez EV, de Araujo CB, Brito-Silva AM, Ivanenko VI, Lipovskii AA
339 - 343	The C-13 NMR properties of low hydroxylated fullerenes with density functional theory Fileti EE, Rivelino R
344 - 347	Graphene-like nano-sheets for surface acoustic wave gas sensor applications Arsat R, Breedon M, Shafiei M, Spizziri PG, Gilje S, Kaner RB, Kalantar-Zadeh K, Wlodarski W
348 - 353	Insertion of transition metal atoms and ions into the nanoscale dodecahedral silsesquioxane (T-12-POSS) cage: Structures, stabilities and electronic properties Hossain D, Gwaltney SR, Pittman CU, Saebo S
354 - 357	Exponential decay of relaxation effects at LaAlO3/SrTiO3 heterointerfaces Schwingenschlogl U, Schuster C
358 - 360	Adsorption-/desorption-limited diffusion of porphyrin molecules in nano-porous TiO2 networks Durr M, Obermaier M, Yasuda A, Nelles G
361 - 364	Graphene sheets via microwave chemical vapor deposition Yuan GD, Zhang WJ, Yang Y, Tang YB, Li YQ, Wang JX, Meng XM, He ZB, Wu CML, Bello I, Lee CS, Lee ST
365 - 368	Theoretical prediction of ring structures for ZnS quantum dots Pal S, Sharma R, Goswami B, Sarkar P
369 - 374	Single-molecule DNA conductance in water solutions: Role of DNA low-frequency dynamics Starikov EB, Quintilla A, Nganou C, Lee KH, Cuniberti G, Wenzel W
375 - 380	Conformational dependence of anharmonic NH stretch vibration in peptides Wang JP
381 - 386	Anomalous reaction of oxide radical ion with 5-azacytosines: An experimental and theoretical study Prasanthkumar KP, Mohan H, Pramod G, Suresh CH, Aravindakumar CT
387 - 392	Theoretical studies on the bonding of Cd2+ to adenine and thymine: Tautomeric equilibrium and metalation in base pairing Wu Y, Sa RJ, Li QH, Wei YQ, Wu KC
393 - 397	Theoretical studies on the nature of bonding in sigma-hole complexes Mohajeri A, Pakiari AH, Bagheri N
398 - 401	'Ex situ' magnetic resonance volume imaging Demas V, Franck JM, Bouchard LS, Sakellariou D, Meriles CA, Martin R, Prado PJ, Bussandri A, Reimer JA, Pines A
402 - 406	The adiabatic electron affinities (EAs) for the heteroatomic molecule SO4: An MP2/CBS study Zheng WX, Lau KC, Wong NB, Li WK
407 - 411	On the use of descriptors arising from the conceptual density functional theory for the prediction of chemicals explosibility Fayet G, Joubert L, Rotureau P, Adamo C
412 - 416	Second-order quadrupolar shifts as an NMR probe of fast molecular-scale dynamics in solids Kurkiewicz T, Thrippleton MJ, Wimperis S
417 - 423	Application of the fragment molecular orbital method for determination of atomic charges on polypeptides. II. Towards an improvement of force fields used for classical molecular dynamics simulations Okiyama Y, Watanabe H, Fukuzawa K, Nakano T, Mochizuki Y, Ishikawa T, Ebina K, Tanaka S
424 - 429	Terahertz spectroscopy of L-proline in reverse aqueous micelles Cooksey CC, Greer BJ, Heilweil EJ
430 - 434	Direct Monte Carlo evaluation of real-time quantum correlation functions using single-step propagators Kegerreis J, Makri N
435 - 438	Hybrid Monte-Carlo simulations of fluorescence anisotropy decay in three-component donor-mediator-acceptor systems in the presence of energy transfer Kulak L