| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A G4MP2 and G4 theoretical study on reactions occurring during the ozonation of bromide containing waters
|
Rayne, Sierra
|
|
2014
|
1031 |
C |
p. 22-33
12 p.
|
artikel
|
| 2 |
A study of Al n (n =5, 6) cluster bonding with some intermediate products of energetic materials
|
Li, Huiran
|
|
2014
|
1031 |
C |
p. 34-39
6 p.
|
artikel
|
| 3 |
A theoretical investigation of the α-MnO2 (110) surface
|
Liu, Yue
|
|
2014
|
1031 |
C |
p. 1-6
6 p.
|
artikel
|
| 4 |
Computational screening of solid electrolyte interphase forming additives in lithium-ion batteries
|
Han, Young-Kyu
|
|
2014
|
1031 |
C |
p. 64-68
5 p.
|
artikel
|
| 5 |
Density functional theory study on the “Molecular Taekwondo” process of pyrene-armed calix[4]azacrowns
|
Li, Ling
|
|
2014
|
1031 |
C |
p. 40-49
10 p.
|
artikel
|
| 6 |
Editorial Board
|
|
|
2014
|
1031 |
C |
p. IFC-
1 p.
|
artikel
|
| 7 |
Effects of positive and negative ionization for 2-aminopyrimidine in the gas phase and in water solution
|
Raczyńska, Ewa D.
|
|
2014
|
1031 |
C |
p. 56-63
8 p.
|
artikel
|
| 8 |
Photochemical dynamics simulations for trans–cis photoisomerizations of azobenzene and bridged azobenzene
|
Gao, Ai-Hua
|
|
2014
|
1031 |
C |
p. 13-21
9 p.
|
artikel
|
| 9 |
Polarizability, hardness and electrophilicity as global descriptors for intramolecular proton transfer reaction path
|
Ash, Sankarlal
|
|
2014
|
1031 |
C |
p. 50-55
6 p.
|
artikel
|
| 10 |
Push–pull effect on the electronic, optical and charge transport properties of the benzo[2,3-b]thiophene derivatives as efficient multifunctional materials
|
Irfan, Ahmad
|
|
2014
|
1031 |
C |
p. 76-82
7 p.
|
artikel
|
| 11 |
The Li-substituted effect on the geometries and second-order nonlinear optical properties of indeno[1,2-b]fluorene
|
Song, Hongjuan
|
|
2014
|
1031 |
C |
p. 7-12
6 p.
|
artikel
|
| 12 |
Theoretical investigations on the reaction kinetics of CH3OCl/CD3OCl with chloride ion
|
Zhao, Xiaoling
|
|
2014
|
1031 |
C |
p. 69-75
7 p.
|
artikel
|
Tijdschrift beschrijving