1 - 5 |
Tug of war between AO-hybridization and aromaticity in dictating structures of Li-doped alkali clusters Alexandrova AN |
6 - 9 |
Temperature dependence of rotational excitation rate coefficients of C2H- in collision with He Dumouchel F, Spielfiedel A, Senent ML, Feautrier N |
10 - 14 |
Conical intersections in the H2CN molecule induced by the distortion from its Renner-Teller arrangement Csehi A, Halasz GJ, Vibok A |
15 - 19 |
Reactions of copper cluster cations with nitrous oxide: Oxidation and sequential N2O adsorption Hirabayashi S, Ichihashi M, Kondow T |
20 - 24 |
Density functional theory study of sulfur tolerance of copper: New copper-sulfur phase diagram Malyi OI, Bai KW, Kulish VV, Wu P, Chen Z |
25 - 29 |
Calculations of the spectral shifts and line profiles of alkaline earth atoms in liquid helium environment Modesto-Costa L, Coutinho K, Mukherjee PK, Canuto S |
30 - 34 |
Temperature dependent vibrational dynamics in crystalline para-terphenyl under high pressure Schatschneider B, Chronister EL |
35 - 39 |
Ab-initio study of structural and vibrational properties of KN3 under pressure Babu KR, Vaitheeswaran G |
40 - 44 |
A weakened structure-breaking effect of Na+ and Cl- on water inside partially filled mesoporous silica Huang XF, Hu JL, Pan LQ, Li CX, Sun G, Lu KQ, Cao ZX, Wang Q |
45 - 49 |
Effect of molecular vibrations on the selectivity character of pyridino-18-crown-6 derivatives towards potassium ion Li Y, Huszthy P, Kunsagi-Mate S |
50 - 55 |
Merging boron solid state and molecular chemistry: Energy landscapes in the exo/endo closo-borane complex Sc[B24H24](+) Oliva JM, Vegas A |
56 - 59 |
In situ mass spectroscopic analysis for chemical vapor deposition synthesis of single-walled carbon nanotubes Tomie T, Inoue S, Matsumura Y |
60 - 64 |
Magnetic properties of Ca-doped Li0.42Na0.36CoO2 Semenova AS, Zabolotskaya EV, Kellerman DG |
65 - 69 |
Novel aspects of Ostwald ripening of supported metal nanoparticles Zhdanov VP, Larsson EM, Langhammer C |
70 - 73 |
Carbon nanotube-silicon hybrid solar cells with hydrogen peroxide doping Bai X, Wang HG, Wei JQ, Jia Y, Zhu HW, Wang KL, Wu DH |
74 - 77 |
Effect of edge-hydrogen passivation and saturation on the carrier mobility of armchair graphene nanoribbons Wang G |
78 - 81 |
Bonding and electronic structure of sillenites Farias SAS, Martins JBL |
82 - 86 |
Selective host-guest chemistry investigated by mass spectrometry: Which of the two, choline or acetylcholine, is the preferred one by the 3iPO triphosphonate-cavitand? Abdoul-Carime H, Harb MM, Montano CG, Cecile T, Farizon B, Farizon M, Vachon J, Harthong S, Dutasta JP, Jeanneau E, Mark TD |
87 - 91 |
Electron attachment to the N-substituted amino acids N-methylglycine and N-methylalanine: Effective cleavage of the N-C-alpha bond at sub-excitation energies Kopyra J |
92 - 94 |
Interaction of a single-stranded DNA-binding protein g5p with DNA oligonucleotides immobilised on a gold surface Solomun T, Sturm H, Wellhausen R, Seitz H |
95 - 99 |
Molecular driving forces of the pocket-ligand hydrophobic association Graziano G |
100 - 105 |
Development of the explicitly correlated Gaussian-nuclear orbital plus molecular orbital theory: Incorporation of electron-electron correlation Nishizawa H, Imamura Y, Ikabata Y, Nakai H |
106 - 113 |
Photoexcitation free energies of solvated molecules from raw absorption spectra: Can a Jarzynski-like equality be employed? Frezzato D |
114 - 117 |
Fukui and dual-descriptor matrices in the basis-set representation: A spin-free approach Alcoba DR, Tiznado W, Ona OB, Torre A, Lain L |