| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A multireference coupled cluster theory based on quantum electrodynamics: Physical aspects of open-shell treatment
|
Datta, Sambhu N.
|
|
|
1180 |
C |
p.
|
artikel
|
| 2 |
Complete degradation of glyoxal by NO radicals through two steps: The first at high-temperatures and the second at low-temperatures
|
Saghafi, Homeira
|
|
|
1180 |
C |
p.
|
artikel
|
| 3 |
C 2 v CO2Li3 +: A superalkali cation with planar pentacoordinate carbon
|
Guo, Jin-Chang
|
|
|
1180 |
C |
p.
|
artikel
|
| 4 |
Editorial Board
|
|
|
|
1180 |
C |
p.
|
artikel
|
| 5 |
Ga and Ge-doped graphene structures: A DFT study of sensor applications for methanol
|
Gecim, Gozde
|
|
|
1180 |
C |
p.
|
artikel
|
| 6 |
Quantitative description of bond lengths alternation for caffeine−effects of ionization, proton-transfer, and noncovalent interaction
|
Raczyńska, Ewa D.
|
|
|
1180 |
C |
p.
|
artikel
|
| 7 |
Quantum-chemical modeling of the fullerene-type (SiC)12 nanocluster for high-performance lithium-ion batteries
|
Voitko, Kateryna V.
|
|
|
1180 |
C |
p.
|
artikel
|
| 8 |
Simple electronic model of enzymatic reactions
|
Turaeva, N.
|
|
|
1180 |
C |
p.
|
artikel
|
| 9 |
The adsorption of NO onto an Al-doped ZnO monolayer and the effects of applied electric fields: A DFT study
|
Qiao, Bin
|
|
|
1180 |
C |
p.
|
artikel
|
| 10 |
The H2S dimer revisited – Insights from wave-function and density functional theory methods. Ab initio molecular dynamics simulations of liquid H2S
|
Lousada, Cláudio M.
|
|
|
1180 |
C |
p.
|
artikel
|
| 11 |
Theoretical investigation on the kinetics of reaction of methoxyflurane (CH3OCF2CHCl2) with OH radical and its atmospheric impact
|
Hynniewta, Shemphang
|
|
|
1180 |
C |
p.
|
artikel
|
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