| no |
title |
author |
magazine |
year |
volume |
issue |
page(s) |
type |
| 1 |
Analytical representation of the Becke–Roussel exchange functional
|
Proynov, Emil
|
|
2008
|
455 |
1-3 |
p. 103-109
7 p.
|
article
|
| 2 |
A note on Kirchhoff index
|
Zhou, Bo
|
|
2008
|
455 |
1-3 |
p. 120-123
4 p.
|
article
|
| 3 |
Appearance of radial breathing modes in Raman spectra of multi-walled carbon nanotubes upon laser illumination
|
Rai, Padmnabh
|
|
2008
|
455 |
1-3 |
p. 83-87
5 p.
|
article
|
| 4 |
Can BB triple bond be as potential proton acceptor: An ab initio study on unusual intermolecular T-shaped X–H···π interactions between OCBBCO and HF, HCl, HCN or H2C2
|
Ren, Fu-de
|
|
2008
|
455 |
1-3 |
p. 32-37
6 p.
|
article
|
| 5 |
Comparison between optimized effective potential and Kohn–Sham methods
|
Heßelmann, Andreas
|
|
2008
|
455 |
1-3 |
p. 110-119
10 p.
|
article
|
| 6 |
Contents
|
|
|
2008
|
455 |
1-3 |
p. iii-ix
nvt p.
|
article
|
| 7 |
Detection of SH and CS radicals by cavity ringdown spectroscopy in a hot filament chemical vapor deposition environment
|
Buzaianu, Madalina D.
|
|
2008
|
455 |
1-3 |
p. 26-31
6 p.
|
article
|
| 8 |
DFT studies on the phenol and thiophenol interaction on an undecagold cluster surface
|
Jayanthi, N.
|
|
2008
|
455 |
1-3 |
p. 64-71
8 p.
|
article
|
| 9 |
Editorial Board
|
|
|
2008
|
455 |
1-3 |
p. IFC-
1 p.
|
article
|
| 10 |
First principles studies of the potential-induced lifting of the Au(100) surface reconstruction
|
Venkatachalam, Sudha
|
|
2008
|
455 |
1-3 |
p. 47-51
5 p.
|
article
|
| 11 |
Fluorescence enhancement of epicocconone in its complexes with cyclodextrins
|
Burai, Tarak Nath
|
|
2008
|
455 |
1-3 |
p. 42-46
5 p.
|
article
|
| 12 |
Hartree–Fock and standard density functional theory methods applied to excited states: The case of NO2
|
Grein, Friedrich
|
|
2008
|
455 |
1-3 |
p. 124-130
7 p.
|
article
|
| 13 |
High-efficiency nondoped green organic light-emitting devices
|
Tong, Qing-Xiao
|
|
2008
|
455 |
1-3 |
p. 79-82
4 p.
|
article
|
| 14 |
Increased stability of C60 encapsulated in double walled carbon nanotubes
|
Scipioni, Roberto
|
|
2008
|
455 |
1-3 |
p. 88-92
5 p.
|
article
|
| 15 |
Isotope effects on the spin-density distribution in the H 6 + clusters: Direct ab initio molecular dynamics study
|
Kurosaki, Yuzuru
|
|
2008
|
455 |
1-3 |
p. 59-63
5 p.
|
article
|
| 16 |
On the excited-state multi-dimensionality in cyanines
|
Dietzek, Benjamin
|
|
2008
|
455 |
1-3 |
p. 13-19
7 p.
|
article
|
| 17 |
Photonic band gap and photoluminescence properties of LaPO4:Tb inverse opal
|
Yang, Zhengwen
|
|
2008
|
455 |
1-3 |
p. 55-58
4 p.
|
article
|
| 18 |
Polarization-dependent two-photon absorption for the determination of protein secondary structure: A theoretical study
|
Wanapun, Duangporn
|
|
2008
|
455 |
1-3 |
p. 6-12
7 p.
|
article
|
| 19 |
Predicting face-to-face arene–arene binding energies
|
Beg, Shana
|
|
2008
|
455 |
1-3 |
p. 98-102
5 p.
|
article
|
| 20 |
Quantum scattering of NO(X2Π) with He(1S): Temperature dependence of rotational (de)-excitation rate coefficients
|
Kłos, J.
|
|
2008
|
455 |
1-3 |
p. 1-5
5 p.
|
article
|
| 21 |
Synthesis and photoluminescence of hollow microspheres constructed with ZnO nanorods by H2 bubble templates
|
Li, Li
|
|
2008
|
455 |
1-3 |
p. 93-97
5 p.
|
article
|
| 22 |
Temperature influence on dual fluorescence of 4-(dimethylamino)benzaldehyde in 1,2-dichloroethane and ethyl acetate
|
Kawski, A.
|
|
2008
|
455 |
1-3 |
p. 52-54
3 p.
|
article
|
| 23 |
The luminescent [Mo6X8(NCS)6]2− (X=Cl, Br, I) clusters?: A computational study based on time-dependent density functional theory including spin–orbit and solvent-polarity effects
|
Ramirez-Tagle, Rodrigo
|
|
2008
|
455 |
1-3 |
p. 38-41
4 p.
|
article
|
| 24 |
Theoretical study on the reaction of bromine-substituted ethanes with hydrogen atoms
|
Wang, Li
|
|
2008
|
455 |
1-3 |
p. 20-25
6 p.
|
article
|
| 25 |
Triplet state properties of [Os(phen)2(dppene)]2+ in different host materials and host to guest energy transfer in PVK
|
Pentlehner, Dominik
|
|
2008
|
455 |
1-3 |
p. 72-78
7 p.
|
article
|
Journal description