1 - 7 |
Quantum scattering study of the abstraction reactions of H atoms from CH3NH2 Kerkeni B, Clary DC |
8 - 13 |
Dissociation dynamics of chloromethyltrimethylsilane at 193 nm Dhanya S, Kumar A, Naik PD |
14 - 19 |
Vibrationally resolved nitrogen K-shell photoelectron spectra of the dinitrogen oxide molecule: Experiment and theory Ehara M, Tamaki R, Nakatsuji H, Lucchese RR, Soderstrom J, Tanaka T, Hoshino M, Kitajima M, Tanaka H, De Fanis A, Ueda K |
20 - 25 |
Relative stabilities of all-metal clusters MAl4- (M = Li+, Na+, K+, Rb+, Cs+, Cu+, Ag+, Au+) Mang CY, Liu CP, Zhou J, Li ZG, Wu KC |
26 - 30 |
DFT characterization of the optical and redox properties of natural pigments relevant to dye-sensitized solar cells Qin CY, Clark AE |
31 - 35 |
Possible EIT-like effects in strong-field photo-dissociation of carbon disulphide Rajgara FA, Mathur D, Ramachandran H |
36 - 40 |
Origin of the Q-band splitting in the absorption spectra of aluminum phthalocyanine chloride Liu K, Wang YH, Yao JN, Luo Y |
41 - 46 |
Modelling of electronic absorption spectrum of Pb(II)-caffeate complex by time-dependent density functional theory Cornard JP, Lapouge C |
47 - 52 |
Nanocrystalline diamond/carbon felt as a novel composite for electrochemical storage energy in capacitor Almeida EC, Azevedo AF, Baldan MR, Braga NA, Rosolen JM, Ferreira NG |
53 - 58 |
Theoretical study on reactions of alkene molecules on H-terminated Si(111): Density functional theory and ab initio molecular dynamics Jiang HH, Yuan SL, Liu G, Wang QL |
59 - 62 |
Radial-breathing mode frequencies for nanotubes encapsulating fullerenes Okada S |
63 - 66 |
In situ X-ray powder diffraction study of one-dimensional polymeric C-60 phase transformation under high-pressure Le Parc R, Levelut C, Haines J, Davydov VA, Rakhmanina AV, Papoular RJ, Belova EE, Chernozatonskii LA, Allouchi H, Agafonov V |
67 - 71 |
ZnO/mesoporous silica nanocomposites prepared by the reverse micelle and the colloidal methods: Photoluminescent properties and quantum size effect Bouvy C, Marine W, Su BL |
72 - 77 |
Theoretical study of adsorption of tabun on calcium oxide clusters Michalkova A, Paukku Y, Majumdar D, Leszczynski J |
78 - 84 |
Hyperstoichiometric hydrogen storage in monodispersed palladium nanoparticles Rather SU, Zacharia R, Hwang SW, Naik MU, Nahm KS |
85 - 88 |
Role and importance of nanoparticles in femtosecond pulsed laser ablation deposition of Al-Cu-Fe quasicrystal Teghil R, De Bonis A, Galasso A, Santagata A, Villani P, Sordelet DJ |
89 - 92 |
An ab initio fragment orbital theory (AFOT) for molecules: Application to some platinum poly-ynes Das GP, Dudis DS, Yeates AT, Blaudeau JP |
93 - 98 |
Reaction force and electron localization function analysis of the metal chelation process in Mg(II)-thymine complex Rincon E, Toro-Labbe A |
99 - 103 |
Complex-rotation treatment on high-lying doubly-excited resonances in H- interacting with screened Coulomb potentials Chakraborty S, Ho YK |
104 - 108 |
MP2 study of anion-pi complexes of trifluoro-s-triazine with tetrahedral and octahedral anions Garau C, Quinonero D, Frontera A, Escudero D, Ballester P, Costa A, Deya PM |
109 - 112 |
Resonant hyper-Raman scattering from carbon nanotubes Ikeda K, Saito Y, Hayazawa N, Kawata S, Uosaki K |
113 - 118 |
Fluorescence anisotropy decay for intramolecular two-state excited-state processes with added quencher in the presence of rotational diffusion: An identifiability analysis Szubiakowski JP, Dale RE, Boens N, Ameloot M |
119 - 126 |
Donor-acceptor interaction and fullerene C-60 dimerization Sheka EF |
127 - 131 |
Wulff's relationship of ruby single crystals grown from molybdenum trioxide flux studied by contact angles of liquid droplets Suzuki T, Iguchi E, Teshima K, Oishi S |
132 - 138 |
Extension of energy density analysis to periodic boundary condition calculation: Evaluation of locality in extended systems Nakai H, Kurabayashi Y, Katouda M, Atsumi T |
139 - 143 |
Hartree-Fock-limit energies and structures with a few dozen distributed Gaussians Tasi G, Csaszar AG |
144 - 147 |
Kinetic equation with memory effect for adsorption-desorption phenomena Zola RS, Freire FCM, Lenzi EK, Evangelista LR, Barbero G |
148 - 152 |
Using reactivity indicators instead of the electron density to describe Coulomb systems Ayers PW |