1 - 8 |
Coupled cluster study of NMR shielding of alkali metal ions in water complexes and magnetic moments of alkali metal nuclei Antusek A, Kedziera D, Kaczmarek-Kedziera A, Jaszunski M |
9 - 12 |
Toward a ligand specific of Pb2+ with respect to the Zn2+ and Ca2+ cations: A track from quantum chemistry van Severen MC, Chaudret R, Parisel O, Piquemal JP |
13 - 18 |
Comparative study on interactions between ionic liquids and pyridine/hexane Lu RQ, Qu ZQ, Yu H, Wang F, Wang ST |
19 - 21 |
The van der Waals potential of mercury dimer Qiao LW, Li P, Tang KT |
22 - 26 |
Nonreactive scattering of the O+ + H-2: A time dependent wave packet approach Klos J, Bulut N, Akpinar S |
27 - 30 |
A new class of halogen bonds that avoids the sigma-hole Zhang Y, Ma N, Wang WZ |
31 - 35 |
Sensitivity of pnicogen, chalcogen, halogen and H-bonds to angular distortions Adhikari U, Scheiner S |
36 - 39 |
Theoretical prediction on low-lying states of HBP and HPB radicals Li WZ, Pei YW, Sun CX, Li QZ, Cheng JB |
40 - 46 |
Structural, electronic and magnetic properties of single transition-metal adsorbed BN sheet: A density functional study Li J, Hu ML, Yu ZZ, Zhong JX, Sun LZ |
47 - 51 |
White-light continuum probed femtosecond time-resolved absorption spectroscopic measurement of beta-carotene under high pressure Liu WL, Zheng ZR, Zhang JP, Wu WZ, Li AH, Zhang W, Huo MM, Liu ZG, Zhu RB, Zhao LC, Su WH |
52 - 56 |
Hyper-efficient quenching of non-conjugated pendant polymer by silver nanoparticles: A demonstration and versatile mechanistic proposition Ghosh D, Chattopadhyay N |
57 - 62 |
High pressure phase transformations in Bis(glycinium)oxalate - An infrared absorption study Bhatt H, Murli C, Garg N, Deo MN, Chitra R, Choudhury RR, Sharma SM |
63 - 67 |
A TD-DFT study of the optical properties of (2,7-fluorene)-heterocyclic derivatives Adegoke A, Wang J, Leszczynski J |
68 - 71 |
An anti-aromatic isomer of fullerene C-60 violating the pentagon adjacent penalty rule Gan LH, Chang Q, Xu L, Huang XL, Shu CY, Wang CR |
72 - 76 |
Photoluminescence properties of Mn-doped ZnxCd1-xS nanocrystals synthesized via nucleation-doping strategy Xu W, Meng XD, Ji WY, Jing PT, Zheng JJ, Liu XY, Zhao JL, Li HB |
77 - 83 |
Transient absorption study on the influence of several polyphenylene vinylene derivatives on the exciton lifetimes in lead(II) sulfide quantum dots Piatkowski P, Gadomski W, Ratajska-Gadomska B, Borysiuk J |
84 - 89 |
Phase transition of metal nanowires confined in a low-dimensional nanospace Shibuta Y |
90 - 95 |
A density functional theory study on the most stable ultra long B-N co-doped (5,5) single walled carbon nanotubes Wang YL, Su KH, Wang X, Liu Y, Ren HJ, Xiao J |
96 - 99 |
Magnetism in Sc-doped ZnO with zinc vacancies: A hybrid density functional and GGA plus U approaches Kanoun MB, Goumri-Said S, Schwingenschlogl U, Manchon A |
100 - 105 |
Near-field coupling of a point-like dipolar source with a thin metallic film: Implication for STM plasmon excitations Marty R, Girard C, Arbouet A, des Francs GC |
106 - 109 |
A quantitative quantum chemical model of the Dewar-Knott color rule for cationic diarylmethanes Olsen S |
110 - 115 |
Novel aminobenzanthrone dyes for amyloid fibril detection Vus K, Trusova V, Gorbenko G, Kirilova E, Kirilov G, Kalnina I, Kinnunen P |
116 - 118 |
Improved extraction of I-V curves from low-energy electron diffraction images Schindler KM, Huth M, Widdra W |
119 - 123 |
Accelerated cluster structure search using electron diffraction data in a genetic algorithm Neiss C, Schooss D |
124 - 130 |
Intermolecular diatomic energies of a hydrogen dimer with non-Born-Oppenheimer nuclear and electron wave packets Hyeon-Deuk K, Ando K |