Chemical Physics Letters

Chemical Physics Letters, Vol.637 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (35 articles)

1 - 6	Poisson-Fermi model of single ion activities in aqueous solutions Liu JL, Eisenberg B
7 - 12	Dielectric properties and alternating current conductivity of sol-gel made La0.8Ca0.2FeO3 compound Benali A, Souissi A, Bejar M, Dhahri E, Graca MFP, Valente MA
13 - 17	Entrance dynamics of CH4 molecules through a methane-water interface Murina EL, Pastorino C, Fernandez-Prini R
18 - 21	Influence of nanoconfinement on the rotational dependence of line half-widths for 2-0 band of carbon oxide Solodov AA, Petrova TM, Ponomarev YN, Solodov AM
22 - 25	Enhancing proton conduction via doping of supramolecular liquid crystals (4-alkoxybenzoic acids) with imidazole Liang T, Wu Y, Tan S, Yang XH, Wei BZ
26 - 31	Electron affinity and ionization potential of two-dimensional honeycomb sheets: A first principle study Deng ZX, Li ZB, Wang WL
32 - 37	Structure of nonuniform four-component fluid mixtures: A systematic investigation through density functional theory and simulation Patra CN
38 - 41	An initiation phenomenon of Al-PTFE under quasi-static compression Feng B, Fang X, Li YC, Wang HX, Mao YM, Wu SZ
42 - 50	Thermodynamic and kinetic stability of zwitterionic histidine: Effects of gas phase hydration Lee SS, Kim JY, Han Y, Shim HJ, Lee S
51 - 57	Approaching the double-faceted nature of the CX bond in halobenzenes with a bifunctional probe El Hage K, Piquemal JP, Hobaika Z, Maroun RG, Gresh N
58 - 62	Layer number dependence of carrier lifetime in graphenes observed using time-resolved mid-infrared luminescence Watanabe H, Kawasaki T, Limori T, Komori F, Suemoto T
63 - 66	The complex kinetics of the ice VI to ice XV hydrogen ordering phase transition Shephard JJ, Salzmann CG
67 - 70	Effect of [PaO4](3-)/[VO4](3-) substitution on the structure and luminescence properties of Ca-5[P,V)O-4)](3)F:Eu3+ phosphors Deng TR, Xia ZG, Ding H
71 - 76	Stability improvement of C8H2 and C10H2 embedded in poly(vinyl alcohol) films with adsorption on gold nanoparticles An K, Wei GT, Qi GM, Sheng LM, Yu LM, Ren W, Zhao XL
77 - 82	Vibrational spectra and conformational analysis of desflurane. A cryosolution and ab initio study Melikova SM, Rutkowski KS, Czarnik-Matusewicz B, Rospenk M
83 - 87	The effect of protonation site and conformation on surface-induced dissociation in a small, lysine containing peptide Shaikh K, Blackwood J, Barnes GL
88 - 93	Negativity of Fukui function of some isolated s and p block elements: The role of orbital relaxation effect Bhattacharjee R, Roy RK
94 - 96	Thermodynamic considerations in the formation of Janus-like TaSi2/Si nanoparticles by electron-beam evaporation Nomoev AV, Radnaev AR, Baldanov BB, Torhov NA, Radnaev BR, Romanov NA, Schreiber M
97 - 102	QM/MM study on the aging mechanism of dichlorvos-inhibited acetylcholinesterase Tang XW, Zhang RM, Zhang QZ, Wang WX
103 - 109	A molecular simulation study of the glass transition of cross-linked poly(dicyclopentadiene) networks Elder RM, Andzelm JW, Sirk TW
110 - 114	Structure and stability of multiply occupied methane clathrate hydrates Liu JX, Liu HY, Xu JF, Chen G, Zhang J, Wang SS
115 - 119	Theoretical analysis on the aromaticity of uracil: Important electronic configurations and solvent effect on the aromaticity Udagawa T
120 - 126	Behavior of the Sapporo-nZP-2012 basis set family Weber R, Hovda B, Schoendorff G, Wilson AK
127 - 131	Effects of Bi3+ ions on luminescence of dumbbell-like SrMoO4 and SrMoO4:Eu3+ microcrystals Bai YH, Bai CY, Mo GL
132 - 136	Studies on electrochemical properties of CuO-In2O3 based nanocomposites Kumar GM, Kumar AM, Ilanchezhiyan P, Kang TW
137 - 142	Effects of morphology and surface area of the oxide nanostructures on the visible-light induced generation of hydrogen in ZnO(TiO2)/Cd1-xZnxS and ZnO(TiO2)/Pt/Cd1-xZnxS heterostructures (x=0.0, 0.2) Roy A, Lingampalli SR, Saha S, Rao CNR
143 - 147	Efficient prediction of high spin ground state stability in organic polyradicals under solvent effects Zhu X, Aoki Y
148 - 152	Vibronic emission spectrum of 2-chloro-6-fluorobenzyl radical produced in corona discharge Yoon YW, Chae SY, Lim M, Lee SK
153 - 158	The influence of carbon hybridization on coupling constants across C-X center dot center dot center dot Cl-F dihalogen bond: A computational study Masoodi HR, Bagheri S
159 - 163	Quasi-superhydrophobic porous silicon surface fabricated by ultrashort pulsed-laser ablation and chemical etching Pan HH, Luo FF, Lin G, Wang CW, Dong MM, Liao Y, Zhao QZ
164 - 171	Electronic structure and second hyperpolarizability of M(NA(2))(2) (M = Be, Mg, Ca; A = H, Li, Na) complexes Banerjee P, Nandi PK
172 - 176	Elucidating the high-k insulator alpha-Al2O3 direct/indirect energy band gap type through density functional theory computations Santos RCR, Longhinotti E, Freire VN, Reimberg RB, Caetano EWS
177 - 181	Metal-ion binding by cyclic halogen-bonded structures: A theoretical study using M-(BrZ)(4) clusters (Z= F or NH2; M = Lit, Nat, or Mg2+) Parra RD
182 - 188	Chemisorption of benzene on Pt (111) surface: A DFT study with van der Waals interaction Ayishabi PK, Lakshmikanth KG, Chatanathodi R
189 - 194	Use of liquid crystals for imaging different inclusion abilities of alpha-cyclodextrin and beta-cyclodextrin toward cetyltrimethyl ammonium bromide Liao ZJ, Du SN, Qin ZL, Wang JY, Zuo F, Luo JB