Chemical Physics Letters

Chemical Physics Letters, Vol.461, No.1-3 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (32 articles)

1 - 8	Downhill dynamics and the molecular rate of protein folding Liu F, Gruebele M
9 - 15	Spiro-linked oligofluorenes and derivatives: Molecular design and theoretical study of one- and two-photon absorption properties Yang ZD, Feng JK, Ren AM
16 - 20	Reactivity of nitrobenzofurazan towards nucleophiles: Insights from DFT Latelli N, Zeroual S, Ouddai N, Mokhtari M, Ciofini I
21 - 27	Gas-phase ion chemistry of BF3/CH4 mixtures: Activation of methane by BF2+ ions Pepi F, Tata A, Garzoli S, Rosi M
28 - 32	IR photodissociation spectroscopy of gas phase Pt+(CO)(n) (n=4-6) Velasquez J, Duncan MA
33 - 37	From correlation-consistent to polarization-consistent basis sets estimation of NMR spin-spin coupling constant in the B3LYP Kohn-Sham basis set limit Kupka T
38 - 41	Ab initio simulation of the fundamental vibrational frequencies of selected pyrite-type pnictides Meier M, Weihrich R
42 - 46	Chain length dependence of folding transition in a semiflexible homo-polymer chain: Appearance of a core-shell structure Higuchi Y, Sakaue T, Yoshikawa K
47 - 52	CH2I2 adsorption and dissociation on Ag(111) surface using density functional theory study Teng BT, Huang WX, Wu FM, Wen XD, Jiang SY
53 - 57	Infrared absorption spectra of ethynyl radicals isolated in solid Ne: Identification of the fundamental C-H stretching mode Wu YJ, Cheng BM
58 - 63	Microphase separation in diblock copolymers with amphiphilic block: Local chemical structure can dictate global morphology Khokhlov AR, Khalatur PG
64 - 70	Silk-inspired'molecular chimeras': Atomistic simulation of nanoarchitectures based on thiophene-peptide copolymers Gus'kova OA, Khalatur PG, Bauerle P, Khokhlov AR
71 - 76	Structural transition and melting of onion-ring Pd-Pt bimetallic clusters Cheng DJ, Cao DP
77 - 81	Time-resolved morphological study of organic thin film solar cells based on calcium/aluminium cathode material Paci B, Generosi A, Albertini VR, Perfetti P, de Bettignies R, Sentein C
82 - 86	Zirconium oxide anodic films: Optical and structural properties Trivinho-Strixino F, Guimaraes FEG, Pereira EC
87 - 92	Host-guest interaction in endohedral fullerenes Ramachandran CN, Roy D, Sathyamurthy N
93 - 96	Charge carrier dynamics in TiO2 nanoparticles at various temperatures Savenije TJ, Huijser A, Vermeulen MJW, Katoh R
97 - 101	Effect of vibrations on the formation of gold nanoparticle aggregates at the toluene-water interface Bera MK, Sanyal MK, Banerjee R, Kalyanikutty KP, Rao CNR
102 - 105	Photoelectrochemical properties of nanocrystalline Aurivillius phase Bi2MoO6 film under visible light irradiation Long MC, Cai WM, Kisch H
106 - 110	Liquid crystal diffusion in thin films investigated by PFG magnetic resonance and magnetic resonance imaging Zhang J, MacGregor RP, Balcom BJ
111 - 113	Selection rules for Brillouin light scattering from eigenvibrations of a sphere Li Y, Lim HS, Ng SC, Wang ZK, Kuok MH
114 - 117	Double-layer silica core-shell nanospheres with superparamagnetic and fluorescent functionalities Li L, Choo ESG, Liu ZY, Ding J, Xue JM
118 - 121	Dynamic second-order hyperpolarizabilities of Si-3 and Si-4 clusters using coupled cluster cubic response theory Lan YZ, Feng YL, Wen YH, Teng BT
122 - 126	Size-induced sign inversion of line tension in nanobubbles at a solid/liquid interface Kameda N, Nakabayashi S
127 - 130	Dimensional scaling for stability of two particles in a dipole field Ferron A, Serra P, Kais S
131 - 135	Intracellular quantification by surface enhanced Raman spectroscopy Shamsaie A, Heim J, Yanik AA, Irudayaraj J
136 - 141	The ozone ring closure as a test for multi-state multi-configurational second order perturbation theory (MS-CASPT2) De Vico L, Pegado L, Heimdal J, Soderhjelm P, Roos BO
142 - 149	Pseudopotential density functional treatment of atoms and molecules in cartesian coordinate grid Roy AK
150 - 154	Modelling tunnelling effects in multidimensional quasiclassical trajectories. Application to the O(P-3)+H-2 reaction Rosa C, Brandao J
155 - 159	Computational investigation of wave packet barrier scattering in the complex plane: Examination of the complex quantum potential utilizing numerical analytic continuation techniques Rowland BA, Wyatt RE
160 - 163	Investigation of the EPR and local defect structures for (FeO6)(9-) and (MnO6)(10-) clusters in TiO2 crystal at different temperature Ying L, Xiao-Yu K, Hui-Li L, Ai-Jie M, Li-Juan T
164 - 169	Current measurements across a nematic cell submitted to an external voltage and its equivalent electrical circuit Atasiei R, Alexe-Ionescu AL, Dias JC, Evangelista LR, Barbero G