nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
1 |
Analytic gradient for the embedding potential with approximations in the fragment molecular orbital method
|
Nagata, Takeshi |
|
2012 |
544 |
C |
p. 87-93 7 p. |
artikel |
2 |
Anomalous charge transfer on a microstructured composite electrode: Application in sensing
|
Gmucová, Katarína |
|
2012 |
544 |
C |
p. 59-63 5 p. |
artikel |
3 |
Contents
|
|
|
2012 |
544 |
C |
p. iii-viii nvt p. |
artikel |
4 |
Correction for the time dependent inner filter effect caused by transient absorption in femtosecond stimulated Raman experiment
|
Kloz, Miroslav |
|
2012 |
544 |
C |
p. 94-101 8 p. |
artikel |
5 |
Dynamics of excited state electron transfer at a liquid interface using time-resolved sum frequency generation
|
Rao, Yi |
|
2012 |
544 |
C |
p. 1-6 6 p. |
artikel |
6 |
Editorial Board
|
|
|
2012 |
544 |
C |
p. IFC- 1 p. |
artikel |
7 |
Enhanced superradiance from a slab of resonant atoms sandwiched between two noble metal plates
|
Manassah, Jamal T. |
|
2012 |
544 |
C |
p. 73-76 4 p. |
artikel |
8 |
EPR and magnetic studies of a novel copper metal organic framework (STAM-I)
|
EL Mkami, H. |
|
2012 |
544 |
C |
p. 17-21 5 p. |
artikel |
9 |
First-principles DFT+U studies of the atomic, electronic, and magnetic structure of α-MnO2 (cryptomelane)
|
Cockayne, Eric |
|
2012 |
544 |
C |
p. 53-58 6 p. |
artikel |
10 |
Hydrophobic hydration displayed by the molal shift in the isentropic compressibility
|
Kaatze, Udo |
|
2012 |
544 |
C |
p. 28-33 6 p. |
artikel |
11 |
Identifying rims along nano-sized clusters as catalytically active sites – The case of CuO x /silica model catalysts nanofabricated by electron beam lithography
|
Chakradhar, A. |
|
2012 |
544 |
C |
p. 70-72 3 p. |
artikel |
12 |
Improved definition of bond orders for correlated wave functions
|
Mayer, I. |
|
2012 |
544 |
C |
p. 83-86 4 p. |
artikel |
13 |
In situ structural characterization of picene thin films by X-ray scattering: Vacuum versus O 2 atmosphere
|
Hosokai, T. |
|
2012 |
544 |
C |
p. 34-38 5 p. |
artikel |
14 |
Long-lived perpendicular conformation in the photoisomerization path of 1,1′-dimethylstilbene and 1,1′-diethylstilbene
|
Berndt, F. |
|
2012 |
544 |
C |
p. 39-42 4 p. |
artikel |
15 |
Lowest-energy structures of (WO3) n (2≤ n ≤12) clusters from first-principles global search
|
Sai, Linwei |
|
2012 |
544 |
C |
p. 7-12 6 p. |
artikel |
16 |
On the optical properties of copper nanocubes as a function of the edge length as modeled by the discrete dipole approximation
|
Alves, Tiago V. |
|
2012 |
544 |
C |
p. 64-69 6 p. |
artikel |
17 |
Polar order disruption in achiral polymeric composites
|
Soto-Bustamante, E.A. |
|
2012 |
544 |
C |
p. 22-27 6 p. |
artikel |
18 |
Positron trapping and possible presence of SO3H clusters in dry fluorinated polymer electrolyte membranes
|
Mohamed, Hamdy F.M. |
|
2012 |
544 |
C |
p. 49-52 4 p. |
artikel |
19 |
Proposal of new QM/MM approach for geometry optimization of periodic molecular crystal: Self-consistent point charge representation for crystalline effect on target QM molecule
|
Aono, Shinji |
|
2012 |
544 |
C |
p. 77-82 6 p. |
artikel |
20 |
Structural XANES characterization of Ca0.99Sm0.01TiO3 perovskite and correlation with photoluminescence emission
|
de Figueiredo, A.T. |
|
2012 |
544 |
C |
p. 43-48 6 p. |
artikel |
21 |
The nuclear electric quadrupole moment of hafnium from the molecular method
|
Haiduke, Roberto L.A. |
|
2012 |
544 |
C |
p. 13-16 4 p. |
artikel |