| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A theoretical study on the decomposition mechanisms of deprotonated glycolic acid
|
Zhu, Haijun
|
|
2013
|
1008 |
C |
p. 32-38
7 p.
|
artikel
|
| 2 |
Bonding properties and isomeric conversion pathways of singlet BeSi4 clusters
|
Hung, Yu-Ming
|
|
2013
|
1008 |
C |
p. 39-45
7 p.
|
artikel
|
| 3 |
Branching ratio of gas-phase reaction of CH3C(O)CHCl2 +OH: A theoretical dynamic study
|
Zhao, Xiao-lei
|
|
2013
|
1008 |
C |
p. 61-66
6 p.
|
artikel
|
| 4 |
Computational analysis of substituent effects and Hammett constants for the ionization of gas phase acids
|
Ziegler, Blake E.
|
|
2013
|
1008 |
C |
p. 46-51
6 p.
|
artikel
|
| 5 |
Correlated backbone torsional potentials in poly(3-methylthiophene)
|
Bhatta, Ram S.
|
|
2013
|
1008 |
C |
p. 90-95
6 p.
|
artikel
|
| 6 |
Cyclization of acyl radical onto NC bond: Application in the synthesis of β-lactam
|
Xiang, Zhang
|
|
2013
|
1008 |
C |
p. 83-89
7 p.
|
artikel
|
| 7 |
DFT study of NO2 adsorption on the AlN nanocones
|
Bagheri, Zargham
|
|
2013
|
1008 |
C |
p. 20-26
7 p.
|
artikel
|
| 8 |
Editorial Board
|
|
|
2013
|
1008 |
C |
p. IFC-
1 p.
|
artikel
|
| 9 |
Electronic response of BC3 nanotube to CS2 molecules: DFT studies
|
Peyghan, Ali Ahmadi
|
|
2013
|
1008 |
C |
p. 1-7
7 p.
|
artikel
|
| 10 |
On several alternatives for Löwdin orthogonalization
|
Szczepanik, D.
|
|
2013
|
1008 |
C |
p. 15-19
5 p.
|
artikel
|
| 11 |
The motion of an ion in a synthetic molecular ion channel
|
Morton-Blake, D.A.
|
|
2013
|
1008 |
C |
p. 74-82
9 p.
|
artikel
|
| 12 |
Theoretical structural and vibrational properties of the artificial sweetener sucralose
|
Brizuela, Alicia Beatriz
|
|
2013
|
1008 |
C |
p. 52-60
9 p.
|
artikel
|
| 13 |
Theoretical studies of intermolecular interactions of arachno-pentaborane (11) with HF and LiH
|
Zabardasti, Abedien
|
|
2013
|
1008 |
C |
p. 27-31
5 p.
|
artikel
|
| 14 |
Theoretical studies on the effect of substituent in the proton transfer reaction of 4-substituted pyrazoles
|
Chermahini, Alireza Najafi
|
|
2013
|
1008 |
C |
p. 67-73
7 p.
|
artikel
|
| 15 |
Theoretical study on the aminolysis of p-substituted phenyl acetates with dimeric ammonia in vacuo and acetonitrile
|
Rao, Han-Bing
|
|
2013
|
1008 |
C |
p. 8-14
7 p.
|
artikel
|
| 16 |
Zwitterions are the most stable form for neutral arginylglycine in gas phase: Clear theoretical evidence
|
Wang, Cuihong
|
|
2013
|
1008 |
C |
p. 96-102
7 p.
|
artikel
|
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