A CASPT2 study of the dipole moment surfaces of hydrogen sulphide moleculeHENON, E; COURS, T; TYUTEREV, Vl. G et al.Chemical physics letters. 2003, Vol 367, Num 3-4, pp 284-292, issn 0009-2614, 9 p.Article

A direct DFT dynamics study of the photodissociation of triplet acetaldehydeCORDEIRO, M. Natalia D. S; MARTINEZ-NUNEZ, Emilio; FERNANDEZ-RAMOS, Antonio et al.Chemical physics letters. 2003, Vol 375, Num 5-6, pp 591-597, issn 0009-2614, 7 p.Article

A new method for distinguishing between Al₂X₆ (X = Cl, Br) conformers based on ab initio calculated nuclear quadrupole coupling constantsHADIPOUR, N. L; ELMI, F.Chemical physics letters. 2003, Vol 371, Num 1-2, pp 56-61, issn 0009-2614, 6 p.Article

A new phase of lithiated titania predicted from first principlesKOUDRIACHOVA, Marina V; DE LEEUW, Simon W; HARRISON, Nicholas M et al.Chemical physics letters. 2003, Vol 371, Num 1-2, pp 150-156, issn 0009-2614, 7 p.Article

A physical evaporation synthetic route to large-scale GaN nanowires and their dielectric propertiesZHOU, S. M; FENG, Y. S; ZHANG, L. D et al.Chemical physics letters. 2003, Vol 369, Num 5-6, pp 610-614, issn 0009-2614, 5 p.Article

A simple large-scale synthesis of very long aligned silica nanowiresHU, J. Q; JIANG, Y; MENG, X. M et al.Chemical physics letters. 2003, Vol 367, Num 3-4, pp 339-343, issn 0009-2614, 5 p.Article

A simple method of producing aligned carbon nanotubes from an unconventional precursor: CamphorKUMAR, Mukul; ANDO, Yoshinori.Chemical physics letters. 2003, Vol 374, Num 5-6, pp 521-526, issn 0009-2614, 6 p.Article

A simple model for thermal conductivity of carbon nanotube-based compositesNAN, C.-W; SHI, Z; LIN, Y et al.Chemical physics letters. 2003, Vol 375, Num 5-6, pp 666-669, issn 0009-2614, 4 p.Article

A theoretical study of strong anharmonic coupling between OH stretching and bending modes in phenol-water cationic complexYAMAMOTO, Norifumi; SHIDA, Norihiro; MIYOSHI, Eisaku et al.Chemical physics letters. 2003, Vol 371, Num 5-6, pp 724-730, issn 0009-2614, 7 p.Article

A theoretical study of the reactions of carbonyl oxide with water in atmosphere: the role of water dimerRYZHKOV, Andrew B; ARIYA, Parisa A.Chemical physics letters. 2003, Vol 367, Num 3-4, pp 423-429, issn 0009-2614, 7 p.Article

A tuneable doubly stacked dielectric resonator housed in an intact TE₁₀₂ cavity for electron paramagnetic resonance spectroscopyMATTAR, Saba M; EMWAS, Abdul H.Chemical physics letters. 2003, Vol 368, Num 5-6, pp 724-731, issn 0009-2614, 8 p.Article

Ab initio MO based lattice energy for molecular crystals: packing structure of electron donor-acceptor (EDA) complex H₃N-BF₃IKEDA, Tohru; NAGAYOSHI, Kanade; KITAURA, Kazuo et al.Chemical physics letters. 2003, Vol 370, Num 1-2, pp 218-226, issn 0009-2614, 9 p.Article

Ab initio molecular dynamics study of liquid methanolHANDGRAAF, Jan-Willem; VAN ERP, Titus S; MEIJER, Evert Jan et al.Chemical physics letters. 2003, Vol 367, Num 5-6, pp 617-624, issn 0009-2614, 8 p.Article

Absorption cross-section of the C₂H molecule: proper treatment of the conical intersectionBILLING, Gert D; BAER, Michael; MEBEL, Alexander M et al.Chemical physics letters. 2003, Vol 372, Num 1-2, pp 1-7, issn 0009-2614, 7 p.Article

Acceleration of charge separation by oscillations of the environment polarizationABRAMAVICIUS, D; GULBINAS, V; VALKUNAS, L et al.Chemical physics letters. 2003, Vol 368, Num 3-4, pp 480-485, issn 0009-2614, 6 p.Article

Adjustment of Perdew-Wang exchange functional for describing van der Waals and DNA base-stacking interactionsKURITA, Noriyuki; INOUE, Hidekazu; SEKINO, Hideo et al.Chemical physics letters. 2003, Vol 370, Num 1-2, pp 161-169, issn 0009-2614, 9 p.Article

Aligned arrays of carbon nanotubes: modulation of orientation and selected-area growthORLANDUCCI, S; SESSA, V; TERRANOVA, M. L et al.Chemical physics letters. 2003, Vol 367, Num 1-2, pp 109-115, issn 0009-2614, 7 p.Article

Anomalous behaviour of emission anisotropy for short living derivatives of stilbeneKUBICKI, Aleksander A.Chemical physics letters. 2003, Vol 373, Num 5-6, pp 471-474, issn 0009-2614, 4 p.Article

Avalanches and self-organized criticality in simulations of particle pilesRIVES, Christopher; LACKS, Daniel J.Chemical physics letters. 2003, Vol 370, Num 5-6, pp 700-705, issn 0009-2614, 6 p.Article

Calculation of packing structure of methanol solid using ab initio lattice energy at the MP2 levelNAGAYOSHI, Kanade; KITAURA, Kazuo; KOSEKI, Shiro et al.Chemical physics letters. 2003, Vol 369, Num 5-6, pp 597-604, issn 0009-2614, 8 p.Article

Calorimetric standards for photothermal methods at the 248 nm excitationWATANABE, Sadayuki; SUZUKI, Tadashi; ICHIMURA, Teijiro et al.Chemical physics letters. 2003, Vol 374, Num 1-2, pp 41-44, issn 0009-2614, 4 p.Article

Carbon dioxide UV laser-induced fluorescence in high-pressure flamesBESSLER, W. G; SCHULZ, C; LEE, T et al.Chemical physics letters. 2003, Vol 375, Num 3-4, pp 344-349, issn 0009-2614, 6 p.Article

Characterization of zinc oxide crystal nanowires grown by thermal evaporation of ZnS powdersYUAN, H. J; XIE, S. S; ZHOU, W. Y et al.Chemical physics letters. 2003, Vol 371, Num 3-4, pp 337-341, issn 0009-2614, 5 p.Article

Characterizing unpaired electrons from the one-particle density matrixHEAD-GORDON, Martin.Chemical physics letters. 2003, Vol 372, Num 3-4, pp 508-511, issn 0009-2614, 4 p.Article

Charge-transfer transitions in triarylamine mixed-valence systems: the effect of temperatureCOROPCEANU, V; LAMBERT, C; NÖLL, G et al.Chemical physics letters. 2003, Vol 373, Num 1-2, pp 153-160, issn 0009-2614, 8 p.Article