Chemical Physics Letters

Chemical Physics Letters, Vol.701 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (25 articles)

1 - 6	Molecular dynamics simulation of the ionic liquid N-octylpyridinium tetrafluoroborate and acetonitrile: Thermodynamic and structural properties Zhou SW, Zhu GL, Kang XQ, Li Q, Sha ML, Cui ZF, Xu XS
7 - 14	Assessment of the overlap metric in the context of RI-MP2 and atomic batched tensor decomposed MP2 Schmitz G, Christiansen O
15 - 21	Rotational cross sections and rate coefficients of aluminium monoxide AlO( X-2 Sigma(+)) induced by its collision with He(S-1) at low temperature Tchakoua T, Nkot PRN, Fifen JJ, Nsangou M, Motapon O
22 - 29	Semi-flexible polymer engendered aggregation/dispersion of fullerene (C-60) nano-particles: An atomistic investigation Kumar S, Pattanayek SK
30 - 33	Au11Re: A hollow or endohedral binary cluster? Carey DM, Munoz-Castro A
34 - 42	DFT investigation on the adsorption behavior of dimethyl and trimethyl amine molecules on borophene nanotube Bhuvaneswari R, Chandiramouli R
43 - 51	The effects of dielectric decrement and finite ion size on differential capacitance of electrolytically gated graphene Daniels L, Scott M, Miskovic ZL
52 - 57	Solvent tuning configurational conversion of lycopene aggregates in organic-aqueous mixing solvent Dong J, Zhang D, Wang XY, Wang P
58 - 64	Assessing therapeutic relevance of biologically interesting, ampholytic substances based on their physicochemical and spectral characteristics with chemometric tools Judycka U, Jagiello K, Bober L, Blazejowski J, Puzyn T
65 - 71	Influence of various force fields in estimating the binding affinity of acetylcholinesterase inhibitors using fast pulling of ligand scheme Tama NM, Vu KB, Vu VV, Ngo ST
72 - 80	Distance numbers and Wiener indices of IPR fullerenes with formula C10(n-2) ( n >= 8) in analytical forms Ghosh T, Mondal S, Mondal S, Mandal B
81 - 85	Double-strand breaks in genome-sized DNA caused by mechanical stress under mixing: Quantitative evaluation through single-molecule observation Kikuchi H, Nose K, Yoshikawa Y, Yoshikawa K
86 - 92	A new orthorhombic ground-state phase and mechanical strengths of ternary B2CO compound Yan HY, Zhang MG, Wei Q, Zhang Y
93 - 97	Comparative study of hydrogen storage on metal doped mesoporous materials Carraro PM, Sapag K, Oliva MI, Eimer GA
98 - 102	Realizing performance improvement of blue thermally activated delayed fluorescence molecule DABNA by introducing substituents on the paraposition of boron atom Gao Y, Pan QQ, Zhao L, Geng Y, Su T, Gao T, Su ZM
103 - 108	Estimation of spin contamination error in dissociative adsorption of Au-2 onto MgO(001) surface: First application of approximate spin projection (AP) method to plane wave basis Tada K, Koga H, Okumura M, Tanaka S
109 - 114	Molecular dynamics simulation of liquid structure for undercooled Zr-Nb alloys assisted with electrostatic levitation experiments Yang SJ, Hu L, Wang L, Wei B
115 - 125	Temperature dependent selective detection of hydrogen and acetone using Pd doped WO3/reduced graphene oxide nanocomposite Kaur J, Anand K, Kohli N, Kaur A, Singh RC
126 - 130	Electron transfer dynamics and yield from gold nanoparticle to different semiconductors induced by plasmon band excitation Du LC, Xi WD, Zhang JB, Matsuzaki H, Furube A
131 - 136	Fullerene-based low-density superhard materials with tunable bandgaps Cao AH, Zhao WJ, Gan LH
137 - 146	Application of the Monte Carlo method for building up models for octanol-water partition coefficient of platinum complexes Toropov AA, Toropova AP
147 - 150	Bulk and grain-boundary ionic conductivity in sodium zirconophosphosilicate Na3Zr2(SiO4)(2)PO4 (NASICON) Lunghammer S, Ma Q, Rettenwander D, Hanzu I, Tietz F, Wilkening HMR
151 - 156	Field emission properties of nano-structured cobalt ferrite (CoFe2O4) synthesized by low-temperature chemical method Ansari SM, Suryawanshi SR, More MA, Sen D, Kolekar YD, Ramana CV
157 - 164	Computational study on night-time reaction of 1, 1-Dichlorodimethylether (DCDME) CH3OCHCl2 with NO3 radical and the fortuity of alkoxy radical CH3OC(O-center dot)Cl-2 Gour NK, Begum SS, Deka RC
165 - 170	The consequences of two distinct reaction coordinates in the decomposition of the ethylamine cation conformers Petersen AC, Solling TI