Chemical Physics Letters

Chemical Physics Letters, Vol.545 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (26 articles)

1 - 8	Intrinsic lifetimes and kinetic stability in media of noble-gas hydrides Gerber RB, Tsivion E, Khriachtchev L, Rasanen M
9 - 13	Ketone physics - structure, conformations, and dynamics of methyl isobutyl ketone explored by microwave spectroscopy and quantum chemical calculations Zhao YY, Stahl W, Ha VLN
14 - 20	A molecular beam scattering investigation of methanol-noble gas complexes: Characterization of the isotropic potential and insights into the nature of the interaction Cappelletti D, Candori P, Falcinelli S, Alberti M, Pirani F
21 - 25	Photoelectron spectroscopy and density functional calculations of CunBO2(OH)(-) (n=1,2) clusters Feng Y, Hou GL, Xu HG, Zhang ZG, Zheng WJ
26 - 28	Magnesium amidoborane monoammoniate: Plane-wave DFT calculations Gotsis HJ, Russo N, Sicilia E
29 - 34	Antiferroelectric domains in liquid crystalline methacrylic polymers Gonzalez-Henriquez CM, Soto-Bustamante EA, Haase W
35 - 39	Dynamics of ultrafast photoinduced heterogeneous electron transfer, implications for recent solar energy conversion scenarios Gundlach L, Burfeindt B, Mahrt J, Willig F
40 - 43	Vibrational vs. electronic coherences in 2D spectrum of molecular systems Butkus V, Zigmantas D, Valkunas L, Abramavicius D
44 - 49	Hydrogen trapped in Be-n cluster cages: The atomic encapsulation option Naumkin FY, Wales DJ
50 - 53	The aromaticity of the [Re-3(mu-X)(3)X-9](3-) clusters, X = Cl, Br, I Alvarado-Soto L, Schott E, Zarate X, Arratia-Perez R, Ramirez-Tagle R
54 - 59	Stokes shift dynamics of [Na][TOTO] - A new class of ionic liquids: A comparative study with more common imidazolium analogs Daschakraborty S, Biswas R
60 - 65	Assessing the importance of Van der Waals interactions on the adsorption of azobenzene on the rutile TiO2(110) surface Ramalho JPP, Illas F
66 - 70	Nonclassical hydrides of Ni+ in ZSM-5 zeolite structures: A hybrid DFT study Georgiev PA, Albinati A
71 - 77	Structural phase transition and band gap of uniaxially deformed (6,0) carbon nanotube Poklonski NA, Ratkevich SV, Vyrko SA, Kislyakov EF, Bubel ON, Popov AM, Lozovik YE, Hieu NN, Viet NA
78 - 82	Fluorinated derivatives of sp(2) graphene allotropes: Structure, stability, and electronic properties Enyashin AN, Ivanovskii AL
83 - 87	Binding properties of a nitrogen atom onto an anionic golden fullerene Au-16(-) Kim G, Kang SH, Lim CY, Kwon YK
88 - 94	Methylation and the system-size effect over the structural, electronic, magnetic (NICS) and reactive properties of pentalene derivatives Barboza CA, Barboza E, Arratia-Perez R, Carey DM
95 - 99	Two-photon absorption of Si-n (n=3-10) clusters compared with Si bulk Lan YZ
100 - 106	Computational study of bond dissociation enthalpies for lignin model compounds: beta-5 Arylcoumaran Younker JM, Beste A, Buchanan AC
107 - 111	Which oxidation state is preferable at S-0 state in oxygen-evolving complex, Mn-4(II, III, IV, IV) or Mn-4(III, III, III, IV)? A B3LYP study Ichino T, Yoshioka Y
112 - 117	Effects of the basis set superposition error on optimized geometries of trimer complexes (Part I) Kim CK, Won J, Kim CK
118 - 124	MDMS: Molecular dynamics meta-simulator for evaluating exchange type sampling methods Smith DB, Okur A, Brooks BR
125 - 131	Analysis of surface structures of hydrogen bonding in protein-ligand interactions using the alpha shape model Zhou WQ, Yan H, Hao Q
132 - 137	Electronic structure study of the triplet azulene-like molecules Radenkovic S, Markovic S, Milenkovic V
138 - 143	The conformational sensitivity of iterative stockholder partitioning schemes Verstraelen T, Ayers PW, Van Speybroeck V, Waroquier M
144 - 147	An atoms-in-molecules study on selected tautomeric triads Zborowski KK