Chemical Physics Letters

Chemical Physics Letters, Vol.514, No.4-6 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (36 articles)

187 - 195	On the hydration and hydrolysis of carbon dioxide England AH, Duffin AM, Schwartz CP, Uejio JS, Prendergast D, Saykally RJ
196 - 201	The (A)over-tilde-(X)over-tilde electronic absorption of cyclopentadienyl peroxy radical (c-C5H5OO center dot): A cavity ringdown spectroscopic and computational study Thomas PS, Miller TA
202 - 206	Fourier-transform microwave spectroscopy of FeCN (X-4 Delta(i)): Confirmation of the quartet electronic ground state Zack LN, Min J, Harris BJ, Flory MA, Ziurys LM
207 - 213	Kinetics and mechanism of gas-phase reactions of n-C4F9OCH3, i-C4F9OCH3, n-C4F9OC(O)H, and i-C4F9OC(O)H with OH radicals in an environmental reaction chamber at 253-328 K Chen L, Uchimaru T, Kutsuna S, Tokuhashi K, Sekiya A
214 - 219	Ultraviolet absorption spectra, structure, vibrations, and theoretical calculations of 2-fluoro- and 3-fluoropyridine in their electronic excited states Boopalachandran P, Kim S, Choo J, Laane J
220 - 225	Kinetic study of the reaction of chlorine atoms with dichloromethane and D-dichloromethane in the gas phase Sarzynski D, Gola AA, Brudnik K, Jodkowski JT
226 - 233	Effects of isomerism on two-photon absorption of substituted benzenes with two pairs of donor-acceptors Liu PW, Zhao K, Han GC
234 - 238	Photodissociation spectroscopy of the temperature-controlled hydrated calcium ion Ishikawa H, Nakano T, Eguchi T, Shibukawa T, Fuke K
239 - 243	A theoretical study of SiCN and SiNC in the (X)over-tilde(2)Pi electronic state based on global potential energy surfaces Tokue I, Nanbu S
244 - 246	A rotational study of the molecular complex tert-butanol center dot center dot center dot 1,4-dioxane Evangelisti L, Caminati W
247 - 250	Energetics of the rotational isomers of thiophenecarboxaldehydes in the ground state Itoh T, Tanaka N, Nishikiori H, Fujii T
251 - 256	A sequential MC/TD-DFT study of the solvatochromic shift of the pyridinium-N-phenoxide betaine dye in water using standard and long-range corrected functionals Oliveira LBA, Fonseca TL, Coutinho K, Canuto S
257 - 260	Geminate-ion escape probability for arbitrary mean free path: Use of the Metropolis method Mozumder A, Wojcik M
261 - 266	On the smoothing of free energy landscape of solute molecules in solution: A demonstration of the stability of glycine conformers via ab initio QM/MM free energy calculation Kitamura Y, Takenaka N, Koyano Y, Nagaoka M
267 - 273	Solvatochromism and electrophilicity Rezende MC, Dominguez M, Aracena A, Millan D
274 - 277	A new polymorph (IV) of benzamide: Structural characterization and mechanism of the I <-> IV phase transition Benoit DM, Ectors P, Duchstein P, Breu J, Zahn D
278 - 283	Synthesis, crystal structure and EPR spectra of tetraaquabis(methylisonicotinate) copper(II) disaccharinate single crystal Celik Y, Bozkurt E, Ucar I, Karabulut B
284 - 290	Raman and infrared spectra of cellobiose in the solid state: What can be learned from single-molecule calculations? Xie HB, Pincu M, Brauer B, Gerber RB, Bar I
291 - 293	Electrode-nanoparticle collisions: The measurement of the sticking coefficient of silver nanoparticles on a glassy carbon electrode Zhou YG, Rees NV, Compton RG
294 - 300	Selective synthesis of carbon nanotubes and multi-layer graphene by controlling catalyst thickness Kondo D, Yagi K, Sato M, Nihei M, Awano Y, Sato S, Yokoyama N
301 - 306	Order-disorder degree of self-assembled clusters: Influence on photoluminescence emission and morphology of BaxSr1-xTiO3 nanocrystals Souza AE, Silva RA, Santos GTA, Teixeira SR, Antonio SG, Moreira ML, Volanti DP, Longo E
307 - 310	Ultra fine scale phase separated microstructure for Ag-Fe nanoparticle Srivastava C, Sinha SK
311 - 316	The adsorption of DNA bases on neutral and charged (8,8) carbon-nanotubes Lv WP
317 - 320	Host-guest inclusion complexes of viologen derivative and tetramethyl cucurbit[6]uril with multiple interaction models Xiao X, Hu QH, Tao Z, Zhang YQ, Xue SF, Zhu QJ, Wei G
321 - 324	Isolation: A strategy for obtaining highly doped heterofullerenes Shakib FA, Momeni MR
325 - 329	Shear-induced lamellar ordering and interfacial sliding in amorphous carbon films: A superlow friction regime Ma TB, Hu YZ, Xu L, Wang LF, Wang H
330 - 335	Early stages of unwinding of zwitterionic alpha-helical homopolymeric peptides Pandey PR, Roy S
336 - 340	A theoretical study of the molecular mechanism of the GAPDH Trypanosoma cruzi enzyme involving iodoacetate inhibitor Carneiro AS, Lameira J, Alves CN
341 - 346	Complex formation of native and hydroxypropylated cyclodextrins with benzoic acid in aqueous solution: Volumetric and H-1 NMR study Terekhova I, Kozbial M, Kumeev R, Gierycz P
347 - 351	Massively parallel implementation of the multireference Brillouin-Wigner CCSD method Brabec J, Krishnamoorthy S, van Dam HJJ, Kowalski K, Pittner J
352 - 356	Statistical correlation between atomic electron pairs Sagar RP, Laguna HG, Guevara NL
357 - 361	Understanding the applicability and limitations of Wang-Landau method for biomolecules: Met-enkephalin and Trp-cage Singh P, Sarkar SK, Bandyopadhyay P
362 - 367	The quantified NTO analysis for the electronic excitations of molecular many-body systems Li JH, Chai JD, Guo GY, Hayashi M
368 - 373	Dielectric boundary force in numerical Poisson-Boltzmann methods: Theory and numerical strategies Cai Q, Ye X, Wang J, Luo R
374 - 378	Theoretical study of the protonation of [Pt-3(mu-L)(3)(L')(3)] (L = CO, SO2, CNH; L' = PH3, CNH) Mendizabal F, Donoso D, Burgos D
379 - 383	Information theoretic properties from the quantum theory of atoms in molecules Matta CF, Sichinga M, Ayers PW