Chemical Physics Letters

Chemical Physics Letters, Vol.634 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (50 articles)

1 - 10	Classical-quantum correspondence in a model for conformational dynamics: Connecting phase space reactive islands with rare events sampling Patra S, Keshavamurthy S
11 - 15	Spatially-encoded intermolecular single-quantum coherence method for high-resolution NMR spectra in inhomogeneous fields Lin YL, Zhang ZY, Cai SH, Chen Z
16 - 19	Length, width and roughness dependent thermal conductivity of graphene nanoribbons Sonvane Y, Gupta SK, Raval P, Lukacevic I, Thakor PB
20 - 24	A State-Specific PCM-DFT method to include dynamic solvent effects in the calculation of ionization energies: Application to DNA bases Munoz-Losa A, Markovitsi D, Improta R
25 - 28	Computational studies of the Ca12O12, Ti12O12, Fe12O12 and Zn12O12 nanocage clusters de Oliveira OV, Pires JM, Neto AC, dos Santos JD
29 - 36	Computational study on the ion interaction of ellipticine: A theoretical approach toward selecting the appropriate anion Paul S, Mallick A, Majumdar T
37 - 41	Improvement of light-harvesting and electron injection efficiencies by lithium ion in D149-sensitized nanocrystalline TiO2 films Namekawa A, Katoh R
42 - 46	Spectroscopic evidence of jet-cooled p-methyl-a-methylbenzyl radical Chae SY, Yoon YW, Lim M, Lee SK
47 - 52	Single- and double-wall carbon nanotubes fully covered with tetraphenylporphyrins: Stability and optoelectronic properties from ab initio calculations Orellana W
53 - 59	Chiral glycine formation on cold interstellar grains by quantum tunneling hydrogen-deuterium substitution reactions Oba Y, Watanabe N, Osamura Y, Kouchi A
60 - 65	Structural transition of tellurium encapsulated in confined one-dimensional nanospaces depending on the diameter Kobayashi K, Yasuda H
66 - 70	AsCl radical: The low-lying electronic states and the (1)(3)Pi -> X-3 Sigma(-) Eelectronic transition Pontes MAP, de Oliveira MH, Ferrao LFA, Roberto-Neto O, Neto JDD, Machado FBC
71 - 76	Carborane super-nano-tubes Bhattacharya D, Klein DJ, Oliva JM
77 - 82	Weak interactive forces govern the interaction between a non-ionic surfactant with human serum albumin Ghosh N, Mondal R, Deshmukh A, Dutta S, Mukherjee S
83 - 87	Gaussian-based cutoff scheme on Hartree-Fock exchange term of dielectric-dependent potential Shimazaki T, Nakajima T
88 - 94	Spectroscopic constants relating to ionization from the strongest bonding and inner valence molecular orbital 2 sigma(g) of N-2: An EIP-VUMRCC search Sharma A, Chattopadhyay S, Adhikari K, Sinha D
95 - 97	Screening and assignment of phenylboronic acid and its anhydride formation by NMR spectroscopy Chaudhari SR
98 - 100	Ultraviolet photoelectron spectra of Sc3C2@C-80 Yagi H, Miyazaki T, Okita S, Zaima T, Okimoto H, Izumi N, Nakanishi Y, Shinohara H, Hino S
101 - 107	Accurate potential energy curves of Li-2 and LiH: A Quantum Monte-Carlo (QMC) study Nasiri S, Zahedi M
108 - 112	Diffusion mechanisms at the Pb solid-liquid interface: Atomic level point of view Sun XG, Xiao SF, Deng HQ, Hu WY
113 - 117	The source of the differences in the IR spectral properties of the hydrogen bond in two isomeric thioamide crystals: Thioacetanilide and N-methylthiobenzamide Flakus HT, Hachula B, Turek E, Michta A, Smiszek-Lindert W, Lodowski P
118 - 121	Spectroscopic evidence of alpha,alpha-dichlorobenzyl radical produced by corona discharge of benzotrichloride Yoon YW, Chae SY, Lim M, Lee SK
122 - 128	Carbon dioxide photoconversion driven by visible-light excitation of small carbon nanoparticles in various configurations Sahu S, Cao L, Meziani MJ, Bunker CE, Fernando KAS, Wang P, Sun YP
129 - 133	Radical spin interaction in one-dimensional chains of decamethyl C-60 Narita K, Okada S
134 - 139	Theoretical analysis of the transition-state spectrum of the cyclooctatetraene unimolecular reaction: Three degree-of-freedom model calculations Yoshida T, Tokizaki C, Takayanagi T
140 - 145	CdS/ZnO core/shell nano-heterostructure coupled with reduced graphene oxide towards enhanced photocatalytic activity and photo stability Singh S, Khare N
146 - 150	Isotope effects of ammonia umbrella flip using semiclassical instanton calculations based on discretized path integrals Kawatsu T, Miura S
151 - 155	An approach for the rationalization of melting temperature for deep eutectic solvents from DFT Garcia G, Atilhan M, Aparicio S
156 - 159	Formation of 3-mercaptopropionic acid-ZnxCd1-xSe quantum dots with tunable band gap Geng Y, Chen Q, Zhou CY, Song JH, Wang RF, Zhou LY
160 - 165	A study of the hydration of lysozyme in neat organic solvents using isothermal calorimetry: Effect of water solvation Sirotkin VA, Dudkina EV
166 - 173	Structural evolution of nucleobase clusters using force field models and density functional theory Chiriki S, Dagar A, Bulusu SS
174 - 178	Impact of disorder effect on the percolative conductivity in Nd0.5Ca0.5-xSrxMnO3(0.10 <= x <= 0.25) Xu LS, Fan JY, Zhu Y, Shi YG, Zhang L, Pi L, Zhang YH, Shi DN
179 - 180	Comment on dimension dependence of helium Virgo WL, Herschbach DR
181 - 187	Performance of the divide-and-conquer approach used as an initial guess Shoji M, Kayanuma M, Umeda H, Shigeta Y
188 - 193	Fluorescence and phosphorescence of lutetium(III) and gadolinium(III) porphyrins for the intraratiometric oxygen sensing Kalota B, Tsvirko M
194 - 197	Molecular dynamic simulation for the evaluation of free energy distribution along the reaction coordinates at the initial stage of carbon nanotube nucleation Nishi K, Inoue S, Matsumura Y
198 - 202	FTIR investigation of the equilibrium structure of osmium pentacarbonyl in alcohol solvents Devanny AJ, Baryiames CP, Laperle CM
203 - 209	Electron attachment to chlorinated alcohols Wnorowski K, Wnorowska J, Michalczuk B, Pshenichnyuk SA, Nafikova EP, Asfandiarov NL, Barszczewska W
210 - 215	Bifurcated chalcogen bonds: A theoretical study on the structure, strength and bonding properties Esrafili MD, Mohammadian-Sabet F
216 - 220	UV laser spectroscopy of mass-selected ionic liquid building blocks in the gas-phase Harvey AJA, Sen A, Yoshikawa N, Dessent CEH
221 - 224	Photoexcited riboflavin induces oxidative damage to human serum albumin Hirakawa K, Yoshioka T
225 - 229	High resolution far infrared spectroscopy of HFC-134a using a collisional cooling cell adapted to a synchrotron source Wong A, Medcraft C, Thompson CD, Robertson EG, Appadoo D, McNaughton D
230 - 235	The effect of unequal strand length on short DNA duplex hybridization in a model microarray system: A Monte Carlo simulation study Cooper SJ, Stubbs JM
236 - 242	Nanomechanics of PCNA: A protein-made DNA sliding clamp Rydzewski J, Strzalka W, Nowak W
243 - 248	Combining intrinsic disorder prediction and augmented training of hidden Markov models improves discriminative motif discovery Song T, Bu XT, Gu H
249 - 254	Numerical differentiation method to calculate molecular properties at ground and excited states - Application to Julolidinemalononitrile Louant O, Champagne B, Liegeois V
255 - 260	Structures and electronic properties of neutral and anionic Ca-n (n=2-22) clusters Liang XQ, Huang XM, Su Y, Zhao JJ
261 - 265	Structural rearrangement in gas phase niobium carbide clusters, NbnC3 and NbnC6 Miyajima K, Sobhan MA, Hardy RA, Metha GF, Mafune F
266 - 270	Two photon absorption studies of PVA coated CdSe/ZnSe and CdSe/CdS core/shell nanostructures Sharma M, Tripathi SK
271 - 276	Chemical sensitivity of K-L vacancy transfer probability in compounds of 3d atoms using synchrotron radiation Mirji S, Bennal AS, Badiger NM, Tiwari MK, Lodha GS