Chemical Physics Letters

Chemical Physics Letters, Vol.585 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (39 articles)

1 - 10	Magnetic field effects and the role of spin states in singlet fission Burdett JJ, Piland GB, Bardeen CJ
11 - 14	Near infrared emission of Eu2+ ions in Ca3Sc2Si3O12 Berezovskaya IV, Dotsenko VP, Voloshinovskii AS, Smola SS
15 - 20	Sneaking up on the Criegee intermediate from below: Predicted photoelectron spectrum of the CH2OO- anion and W3-F12 electron affinity of CH2OO Karton A, Kettner M, Wild DA
21 - 26	Electro-optic and spectroscopic properties of push-pull-chromophores with non-aromatic pi-bridges Rinderspacher BC
27 - 32	Theoretical study on the kinetics and the mechanism for the gas-phase reaction of 1-naphtylmethyl radical with molecular oxygen Oguchi T, Murakami Y
33 - 36	Resolution of a significant discrepancy in the electron impact excitation of the 3s[3/2](1) and 3s'[1/2](1) low-lying electronic states in neon Hoshino M, Mura H, Kato H, Itikawa Y, Brunger MJ, Tanaka H
37 - 41	Which isomeric form of formaldehyde dimer is the most stable - a high-level coupled-cluster study Dolgonos GA
42 - 48	Unique determination of the -CN group tilt angle in Langmuir monolayers using sum-frequency polarization null angle and phase Velarde L, Wang HF
49 - 52	Photophysics of diiodine-substituted fluorinated boron-dipyrromethene: A time resolved study Pozdnyakov IP, Aksenova YV, Ermolina EG, Melnikov AA, Kuznetsova RT, Grivin VP, Plyusnin VF, Berezin MB, Semeikin AS, Chekalin SV
53 - 58	The solvation structure and thermodynamics of aqueous vanadium cations Sepehr F, Paddison SJ
59 - 62	First volatility study of the 1-alkylpyridinium based ionic liquids by Knudsen effusion Rocha MAA, Santos LMNBF
63 - 68	Theoretical analysis of an all-photonic multifunctional molecular logic device: Using TD-DFT//DFT to assess photochromic activity of multimeric photochrome Belfon KAA, Gough JD
69 - 73	Molecular kinetics of solid and liquid CHCl3 Caballero NB, Zuriaga M, Carignano MA, Serra P
74 - 79	Low temperature impedance spectroscopy evidence of phase coexistence within bulk Pr0.50Ca0.50MnO3 manganites Iqbal MJ, Nadeem M, Hasan MM
80 - 83	Tuning density fingering by changing stoichiometry in the chlorite-tetrathionate reaction Rica T, Schuszter G, Horvath D, Toth A
84 - 88	Positronium formation in solid transition metal losartanates complexes de Oliveira FC, Denadai AML, Fulgencio F, da Silva JG, Windmoller D, Marques-Netto A, Machado JC, Magalhaes WF
89 - 94	Effects of catalyst surface and hydrogen bond on ethanol dehydrogenation to ethoxy on Cu catalysts Sun K, Zhang MH, Wang LC
95 - 100	Influence of substitution on the optical properties of functionalized pentacene monomers and crystals: Experiment and theory Saeed Y, Zhao K, Singh N, Li R, Anthony JE, Amassian A, Schwingenschlogl U
101 - 106	High pressure transformation of graphene nanoplates: A Raman study Lu SC, Yao MG, Yang XG, Li QJ, Xiao JP, Yao Z, Jiang LH, Liu R, Liu B, Chen SL, Zou B, Cui T, Liu BB
107 - 111	Basis set effect on defect induced spin polarization of a carbon nanotube in density functional theory calculations Xin MS, Dai X, Huang BL, Meng Y, Feng W, Jin MX, Wang ZG, Zhang RQ
112 - 116	Theoretical study on the diradical characters and third-order nonlinear optical properties of cyclic thiazyl diradical compounds Matsui H, Fukuda K, Hirosaki Y, Takamuku S, Champagne B, Nakano M
117 - 120	Au-to-CO electron transfer evidenced by surface-enhanced Raman scattering of 2,6-dimethylphenyl isocyanide Kim K, Lee SH, Kim KL, Shin KS
121 - 127	Combined experimental and DFT-TDDFT study of photo-active constituents of Canarium odontophyllum for DSSC application Ekanayake P, Kooh MRR, Kumara NTRN, Lim A, Petra MI, Yoong VN, Ming LC
128 - 132	Improved catalytic performance of Pd nanowires for ethanol oxidation by monolayer of Pt Huang ZY, Zhou HH, Chang YW, Fu CP, Zeng FY, Kuang YF
133 - 137	Absorption cross-sections of hole polarons in glassy and beta-phase polyfluorene Montilla F, Ruseckas A, Samuel IDW
138 - 142	Suitability of amorphous TiO2 nanoparticles as a photoelectrode in dye sensitized solar cells: A DFT-TDDFT study Eithiraj RD, Geethalakshmi KR
143 - 148	Quantum chemical analysis of salen-aluminum complexes for organic light emitting diodes Kim H, Lee YS
149 - 152	The catalytic adsorption and dissociation of carbon dioxide on a double icosahedral Ru-19 nanocluster - A theoretical study Li HJ, Yeh CH, Ho JJ
153 - 156	Influence of blue valence absorption band on nonlinear absorption in dysprosium bisphthalocyanine studied by open aperture z-scan Karpo AB, Zasedatelev AV, Pushkarev VE, Krasovskii VI, Tomilova LG
157 - 161	Effect of the adsorption of ethylene carbonate on Si surfaces on the Li insertion behavior Carvalho A, Rayson MJ, Briddon PR, Manzhos S
162 - 166	Metal desorption from Fe(110) and its alloyed surfaces Pham HH, Taylor CD, Henson NJ
167 - 170	Size, shape, and temperature dependence of the phonon relaxation dynamics of CdSe nanocrystals Guo NG, Zhou ZF, Huang YL, Yang XX, Jiang R, Ma ZS, Sun CQ
171 - 177	Molecular dynamics simulations reveal insight into key structural elements of aaptamines as sortase inhibitors with free energy calculations Lv Z, Wang HS, Niu XD
178 - 183	Photoinduced excitation energy transfer in hexapyropheophorbide a Megow J, Plehn T, Steffen R, Roder B, May V
184 - 188	Comparison of the multi-configuration, time-dependent Hartree (MCTDH) method with the Arthurs and Dalgarno coupled-channel method for rotationally inelastic scattering Malenda RF, Gatti F, Meyer HD, Talbi D, Hickman AP
189 - 192	Fractional statistics description applied to protein adsorption: Effects of excluded surface area on adsorption equilibria Quiroga E, Riccardo JL, Ramirez-Pastor AJ
193 - 197	Electrochemical impedance spectroscopy of dye-sensitized solar cells with thermally degraded N719 loaded TiO2 Sarker S, Seo HW, Kim DM
198 - 200	Relation between the Hilbert space and "fuzzy atoms" analyses Mayer I
201 - 206	Non-empirical tuning of CAM-B3LYP functional in time-dependent density functional theory for excitation energies of diarylethene derivatives Okuno K, Shigeta Y, Kishi R, Nakano M