| no |
title |
author |
magazine |
year |
volume |
issue |
page(s) |
type |
| 1 |
Ab initio study of the low-lying electronic states of the C 2 − anion
|
Shi, Weixin
|
|
2016
|
1079 |
C |
p. 57-63
7 p.
|
article
|
| 2 |
Addendum to “More insight in multiple bonding with valence bond theory” [Comput. Theor. Chem. 1053 (2015) 180–188]
|
Hendrickx, K.
|
|
2016
|
1079 |
C |
p. 70-
1 p.
|
article
|
| 3 |
A density functional study of small neutral, anionic, and cationic indium clusters In n , In n −, and In n + (n =2–15)
|
Shi, Shunping
|
|
2016
|
1079 |
C |
p. 47-56
10 p.
|
article
|
| 4 |
Editorial Board
|
|
|
2016
|
1079 |
C |
p. IFC-
1 p.
|
article
|
| 5 |
Mechanistic insight into the prebiotic syntheses of pyrimidine ribonucleotide and pyrimidine deoxynucleotide precursors
|
Xie, Lihuan
|
|
2016
|
1079 |
C |
p. 11-22
12 p.
|
article
|
| 6 |
Structural, electronic, thermodynamic and spectral properties of Mg n (n =2–31) clusters. A DFT study
|
Belyaev, Sergey N.
|
|
2016
|
1079 |
C |
p. 34-46
13 p.
|
article
|
| 7 |
The equilibrium geometries of heptatriynylidene, cyclohepta-1,2,3,4-tetraen-6-yne, and heptahexaenylidene
|
Thimmakondu, Venkatesan S.
|
|
2016
|
1079 |
C |
p. 1-10
10 p.
|
article
|
| 8 |
Theoretical study of the substituent effect on the hydrogen atom transfer mechanism of meta- and para-substituted benzenetellurols
|
Škorňa, Peter
|
|
2016
|
1079 |
C |
p. 64-69
6 p.
|
article
|
| 9 |
These effects of spin–orbit coupling, core–valence correlation and scalar relativistic correction on spectroscopic calculations for PN+ cation
|
Zhu, ZunLue
|
|
2016
|
1079 |
C |
p. 23-33
11 p.
|
article
|
Journal description