| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A computational investigation of CO oxidation on ruthenium-embedded hexagonal boron nitride nanosheet
|
Huang, Caijin
|
|
2013
|
1011 |
C |
p. 5-10
6 p.
|
artikel
|
| 2 |
Application of the reaction class transition state theory to the kinetics of hydrogen abstraction reactions of alkanes by atomic chlorine
|
Piansawan, Tammarat
|
|
2013
|
1011 |
C |
p. 65-74
10 p.
|
artikel
|
| 3 |
Conformational analysis of retinoic acids: Effects of steric interactions on nonplanar conjugated polyenes
|
Cox, Bryan D.
|
|
2013
|
1011 |
C |
p. 11-20
10 p.
|
artikel
|
| 4 |
Editorial Board
|
|
|
2013
|
1011 |
C |
p. IFC-
1 p.
|
artikel
|
| 5 |
Enthalpies of formation of mono substituted nitrobenzenes: A quantum chemistry study
|
Khrapkovskii, G.M.
|
|
2013
|
1011 |
C |
p. 37-43
7 p.
|
artikel
|
| 6 |
Gas phase Lewis acidity and basicity scales for boranes, phosphines and amines based on the formation of donor–acceptor complexes
|
Méndez, Mariano
|
|
2013
|
1011 |
C |
p. 44-56
13 p.
|
artikel
|
| 7 |
Reliable approach for prediction of heats of formation of polycyclic saturated hydrocarbons using recently developed density functionals
|
Keshavarz, Mohammad Hossein
|
|
2013
|
1011 |
C |
p. 30-36
7 p.
|
artikel
|
| 8 |
Structural and vibrational studies of the potential anticancer agent, 5-difluoromethyl-1,3,4-thiadiazole-2-amino by DFT calculations
|
Romano, Elida
|
|
2013
|
1011 |
C |
p. 57-64
8 p.
|
artikel
|
| 9 |
Theoretical investigation for the mediated activation of the C–CN in CH3CN by Zr atom in the gas phase
|
Jin, Yanzi
|
|
2013
|
1011 |
C |
p. 75-81
7 p.
|
artikel
|
| 10 |
Theoretical prediction on low-lying states of HAlP and HPAl radicals
|
Li, Wen-Zuo
|
|
2013
|
1011 |
C |
p. 1-4
4 p.
|
artikel
|
| 11 |
Theoretical study on thermochemical parameters and pKa values for fluorinated isomers of toluene
|
Zanganeh, Jafar
|
|
2013
|
1011 |
C |
p. 21-29
9 p.
|
artikel
|
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