Chemical Physics Letters

Chemical Physics Letters, Vol.406, No.4-6 Entire volume, number list

ISSN: 0009-2614 (Print)

In this Issue (43 articles)

283 - 288	Configuration interaction singles method with multilayer fragment molecular orbital scheme Mochizuki Y, Koikegami S, Amari S, Segawa K, Kitaura K, Nakano T
289 - 293	Laser-based synthesis of core Ag-shell AgI nanoparticles Tan H, Fan WY
294 - 299	Electronic structure calculations of radical reactions for poly(methyl methacrylate) degradation Conforti PF, Garrison BJ
300 - 305	The enthalpy of the O-H bond hornolytic dissociation: Basis-set extrapolated density functional theory and coupled cluster calculations Cabral BJC, Canuto S
306 - 311	Density functional study of the TiO2-dopamine complex Vega-Arroyo M, LeBreton PR, Rajh T, Zapol P, Curtiss LA
312 - 317	A new perspective on the mechanism of asymmetric amplification Asakura K, Yamamoto T, Inoue S, Osanai S, Kondepudi DK, Yamaguchi T
318 - 320	The MP2 energy as a functional of the Hartree-Fock density matrix Surjan NR
321 - 326	Entrance channel complexes of cationic aromatic S(N)2 reactions: IR spectra of fluorobenzene(+)-(H2O)n clusters Lorenz U, Solca N, Dopfer O
327 - 331	The influence of the structure of the radical cation dimer pair of aromatic molecules on the principal values of a g-tensor: DFT predictions Petrenko A, Redding K, Kispert LD
332 - 340	Molecular dynamics study of the ionic conductivity of 1-n-butyl-3-methylimidazolium salts as ionic liquids Lee SU, Jung J, Han YK
341 - 344	Encapsulation of halide anions in perhydrogenated silicon fullerene: X-@Si20H20 (X = F, Cl, Br, I) Pichierri F, Kumar V, Kawazoe Y
345 - 350	Time-resolved kinetic studies on quenching of HCCl(A)over-tilde(1) A''(040)) by alkane and alcohol molecules Yang XL, Liu YZ, Wang HL, Chen Y, Chen CX
351 - 354	Theoretical study of the HCN-CH3 and HNC-CH3 radicals: Hydrogen and covalent bonding Solimannejad M, Alikhani ME
355 - 359	Hydrogen bond stabilization in Diels-Alder transition states: The cycloaddition of hydroxy-ortho-quinodimethane with fumaric acid and dimethylfumarate Tamilmani V, Daul CA, Robles JL, Bochet CG, Venuvanalingam P
360 - 365	Preferential formation of mixed dimers in aluminium containing porphyrin-phthalocyanine systems: A photophysical study Pereira MR, Ferreira JA, Hungerford G
366 - 370	Hydroperoxy radical as hydrogen bond donor: NH3-HOO complex - ab initio and topological study Bil A, Latajka Z
371 - 374	Adiabatic corrections to the energies of 50 typical medium size molecules containing H atoms Mohallem JR, Goncalves CP, Moreira T
375 - 380	Influence of extra-framework cations on the diffusion of alkanes in silicalite: Comparison between quasi-elastic neutron scattering and molecular simulations Leroy F, Jobic H
381 - 385	Oriented silicon nanowires on silicon substrates from oxide-assisted growth and gold catalysts Yao Y, Li FH, Lee ST
386 - 392	Electronic spectroscopy of anthracene molecules trapped in helium nanodroplets Krasnokutski S, Rouille G, Huisken F
393 - 397	An electron localization function study of the trimerization of acetylene: Reaction mechanism and development of aromaticity Santos JC, Polo V, Andres J
398 - 403	Evidence for blueshift by weak exciton confinement and tuning of bandgap in superparamagnetic nanocomposites Nair SS, Mathews M, Anantharaman MR
404 - 408	Fate of several hydroxyalkyl isoprene radicals: Formation of hydroxycarbonyl compounds Ramirez-Ramirez VM, Nebot-Gil I
409 - 414	Free energy and entropy calculations in the conformational equilibrium of 1,2-dichloroethane in water Madurga S, Vilaseca E
415 - 419	NH3(nu(2)) inversion doubling and two-mode interaction of PH3(nu(4),nu(2)) in V-V energy transfer with PH2((X)over-tilde(2)B(1);upsilon(2)''=1) Xuan CN
420 - 424	Preparation and photophysical properties of nanostructured 9-cyanoanthracene Pal SK, Batabyal SK, Ganguly T
425 - 429	Self-assembled methanofullerene vesicles and their encapsulation of pyrene Li JX, Sun N, Zhang P, Guo ZX, Zhu DB
430 - 435	Ab initio study of the water adsorption on hydroxylated graphite surfaces Collignon B, Hoang PNM, Picaud S, Rayez JC
436 - 440	Spectroscopic properties of Pr3+:: D-1(2)->(1)G(4) transition in SiO2-based glasses Choi YG, Baik JH, Heo J
441 - 445	Investigation of the CO+NO reaction over the Cu(001) surface Godowski PJ, Onsgaard J, Gagor A, Kondys M, Li ZS
446 - 451	Theoretical study of the dehydrogenation reaction of ethane catalyzed by zeolites containing non-framework gallium species: The 3-step mechanism x the 1-step concerted mechanism Pereira MS, Nascimento MAC
452 - 456	Dipolar field effects described by boson operators techniques: The case of intermolecular multiple-quantum coherences in liquids Nosel W, Gili T, Capuani S, Maraviglia B
457 - 461	Fractal dimension and photoluminescence of ZnO tetrapod nanowhiskers Wu R, Yang Y, Cong S, Wu ZG, Xie CS, Usui H, Kawaguchi K, Koshizaki N
462 - 466	Three-photon absorption enhancement in symmetrical charge transfer pull-pull fluorene derivatives Cohanoschi I, Belfield KD, Hernandez FE
467 - 473	Accuracy and sensitivity of determining molecular orientation at interfaces using sum frequency generation vibrational spectroscopy Gan W, Wu BH, Chen H, Guo Y, Wang HF
474 - 478	Orientation of nitrous oxide on palladium(110) by STM Watanabe K, Kokalj A, Inokuchi Y, Rzeznicka I, Ohshimo K, Nishi N, Matsushima T
479 - 482	Optical spectra of quantum dots: A non-adiabatic approach Cheche TO, Chang MC
483 - 488	Ab initio quantum chemical study of electron transfer in carboranes Pati R, Pineda AC, Pandey R, Karna SP
489 - 494	The importance of tunneling effect to the decomposition of 2,2-dimethoxypropane and 2,2-diethoxypropane Jiang H, Li HR, Wu T, Han SJ
495 - 500	Air-liquid interface of ionic liquid plus H2O binary system studied by surface tension measurement and sum-frequency generation spectroscopy Sung J, Jeon Y, Kim D, Iwahashi T, Iimori T, Seki K, Ouchi Y
501 - 503	The magnitude of pseudo-potential errors for density functional calculations Janfelt C, Jensen F
504 - 508	Conformational properties of poly (vinyl Fluoride) based upon ab initio electronic structure calculations Zhang ZJ, Lu ZY, Li ZS, Sun CC
509 - 518	pi-electronic charge-transfer interactions in supramolecular complex formation between fullerenes and 5,10,15,20-tetrahexylporphyrin Bhattacharya S, Komatsu N, Banerjee M