Chemical Physics Letters

Chemical Physics Letters, Vol.679 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (37 articles)

1 - 5	Anisotropic amplification of proton transport in proton exchange membrane fuel cells Thimmappa R, Fawaz M, Devendrachari MC, Gautam M, Kottaichamy AR, Shafi SP, Thotiyl MO
6 - 14	Multiscale simulation on shearing transitions of thin-film lubrication with multi-layer molecules Wu ZB, Zeng XC
15 - 20	A study of the photoelectron spectra of alpha-tetrahydrofurfuryl alcohol over the outer valence energy region (9-25 eV) Dampc M, Mielewska B, Siggel-King MRF, King GC, Zubek M
21 - 24	Mobilities of CH3O+, C2H5O+ and C3H7O+ ions in He gas Takaya K, Hasegawa Y, Koizumi T
25 - 30	Evolution of the nitrogen depth distribution in an implanted titanium alloy with a surface carbon nanolayer Vlcak P, Horazdovsky T, Valenta R, Kovac J
31 - 37	Influence of valine enantiomer configuration on the molecular dynamics simulation of their separation by beta-cyclodextrin Alvira E
38 - 44	Recollision induced excitation-ionization with counter-rotating two-color circularly polarized laser field Ben S, Guo PY, Pan XF, Xu TT, Song KL, Liu XS
45 - 51	Raman intensity and vibrational modes of armchair CNTs Hur J, Stuart SJ
52 - 59	Natural transition orbitals for the calculation of correlation and excitation energies Hofener S, Klopper W
60 - 65	Theoretical study on photoexcitation dynamics of a bis-diimine Cu(I) complex in solutions Agena A, Iuchi S, Higashi M
66 - 70	DFT-based study on the optimal CH3OH decomposition pathways in aqueous-phase: Homolysis versus heterolysis Ou LH, Huang JX
71 - 76	Fe-N-doped carbon catalysts prepared by hybrid PECVD/sputtering system for oxygen reduction reaction Hotozuka K, Yoshie R, Murata H, Tateno A, Ito G, Kawaguchi N, Matsuo T, Ito H, Kinoshita I, Tachibana M
77 - 85	Ions and size effects in nanoparticle/liquid crystal colloids sandwiched between two substrates. The case of two types of fully ionized species Garbovskiy Y
86 - 89	Liquid water changes its structure at 43 degrees C Catalan J, Gonzalo JA
90 - 96	Solvation effect on isomer stability and electronic structures of protonated serotonin Omidyan R, Amanollahi Z, Azimi G
97 - 101	Dye-sensitized solar cells using Aloe Vera and Cladode of Cactus extracts as natural sensitizers Ganta D, Jara J, Villanueva R
102 - 111	A comprehensive study of the optoelectronic properties of donor-acceptor based derivatives of 1,3,4-oxadiazole Joshi A, Ramachandran CN
112 - 118	A test of AMBER force fields in predicting the secondary structure of alpha-helical and beta-hairpin peptides Gao Y, Zhang CM, Wang XW, Zhu T
119 - 126	Ag nanoparticle-functionalized ZnO micro-flowers for enhanced photodegradation of herbicide derivatives Xu Y, Wu SM, Li XL, Meng H, Zhang X, Wang ZP, Han YD
127 - 131	Towards a metal-semiconductor transition in two dimensions Hansson A, Mota FD, Rivelino R
132 - 136	Solving the non-isothermal reaction-diffusion model equations in a spherical catalyst by the variational iteration method Wazwaz AM
137 - 145	Commercial ZnO and its hybrid with Ag nanoparticles: Photocatalytic performance and relationship with structure Dong YY, Jiao YQ, Jiang BJ, Tian CG
146 - 151	On nearsightedness in metallic systems for O(N) Density Functional Theory calculations: A case study on aluminum Suryanarayana P
152 - 157	A fragmentation-based approach for evaluating the intra-chain excitonic couplings in conjugated polymers Wen J, Ma HB
158 - 163	Photoinduced charge-transfer electronic excitation of tetracyanoethylene/tetramethylethylene complex in dichloromethane Xu LK, Bi TJ, Ming MJ, Wang JB, Li XY
164 - 171	Conformation and catalytic activity of nickel-carbon cluster for ethanol dissociation in carbon nanotube synthesis: Ab initio molecular dynamics simulation Fukuhara S, Shimojo F, Shibuta Y
172 - 175	Specific heat capacity of liquid and solid Ni83.5Ti16.5 eutectic alloy Luo SB, Wang WL, Chang J, Xia ZC, Wei B
176 - 180	First principle study of PEO-AgI polymer systems Rao BK, Verma ML
181 - 184	Growth of monolayer MoS2 films in a quasi-closed crucible encapsulated substrates by chemical vapor deposition Yang Y, Pu HB, Lin T, Li LB, Zhang S, Sun GP
185 - 192	Comparative EPR studies of free radicals in melanin synthesized by Bacillus weihenstephanensis soil strains Zdybel M, Pilawa B, Drewnowska JM, Swiecicka I
193 - 199	Hidden radical reactivity of the [FeO](2+) group in the H-abstraction from methane: DFT and CASPT2 supported mechanism by the example of model iron (hydro)oxide species Kovalskii V, Shubin A, Chen Y, Ovchinnikov D, Ruzankin SP, Hasegawa J, Zilberberg I, Parmon VN
200 - 206	Theoretical study on in situ synthesis of Pt/Ni-Al hydroxide composites by etching of Pt-Ni nanoparticles Zhou YC, Zhou G, Li J
207 - 211	X-ray photoelectron spectroscopy of trihalide ionic liquids: Comparison to halide-based analogues, anion basicity and beam damage Men SA, Lovelock KRJ, Licence P
212 - 218	High pressure-high temperature phase diagram of an energetic crystal: Dihydroxylammonium 5,5 '-bistetrazole-1,1 '-diolate (TKX-50) Dreger ZA, Breshike CJ, Gupta YM
219 - 224	Gas-phase standard enthalpies of formation of urea-derived compounds: A quantum-chemical study Gratzfeld D, Olzmann M
225 - 232	Influence of a graphene surface on the first steps of the hydrogenation of a coronene molecule Morisset S, Rougeau N, Teillet-Billy D
233 - 236	Accurate quantitative and maximum cross polarization via multiple ramped contacts Liu HW, Zhou XY, Chen Q, Zhang SM