| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A computational study of anion photoelectron spectroscopy of zinc oxide nanoclusters
|
Majid, Abdul
|
|
2014
|
1050 |
C |
p. 23-30
8 p.
|
artikel
|
| 2 |
Binary Lennard-Jones atomic clusters: Structural features induced by large-sized atoms
|
Takeuchi, Hiroshi
|
|
2014
|
1050 |
C |
p. 68-73
6 p.
|
artikel
|
| 3 |
Characterization of structure and dynamics of the solvated indium(III) ion by an extended QM/MM molecular dynamics simulation
|
Vchirawongkwin, Viwat
|
|
2014
|
1050 |
C |
p. 74-82
9 p.
|
artikel
|
| 4 |
Editorial Board
|
|
|
2014
|
1050 |
C |
p. IFC-
1 p.
|
artikel
|
| 5 |
Hyperfine electron affinities of molecular oxygen
|
Chen, Edward S.
|
|
2014
|
1050 |
C |
p. 89-95
7 p.
|
artikel
|
| 6 |
Interplay between tetrel bonding and hydrogen bonding interactions in complexes involving F2XO (X=C and Si) and HCN
|
Tang, Qingjie
|
|
2014
|
1050 |
C |
p. 51-57
7 p.
|
artikel
|
| 7 |
JANPA: An open source cross-platform implementation of the Natural Population Analysis on the Java platform
|
Nikolaienko, Tymofii Y.
|
|
2014
|
1050 |
C |
p. 15-22
8 p.
|
artikel
|
| 8 |
Linear monometallic cyanide cluster fullerenes ScCN@C76 and YCN@C76: A theoretical prediction
|
Meng, Qing-Ya
|
|
2014
|
1050 |
C |
p. 83-88
6 p.
|
artikel
|
| 9 |
Organotin bond dissociation energies: An interesting challenge for contemporary computational methods
|
Adams, Matt R.
|
|
2014
|
1050 |
C |
p. 7-14
8 p.
|
artikel
|
| 10 |
Reaction enthalpies of OH bonds splitting-off in flavonoids: The role of non-polar and polar solvent
|
Vagánek, Adam
|
|
2014
|
1050 |
C |
p. 31-38
8 p.
|
artikel
|
| 11 |
The mechanism investigation of chiral phosphoric acid-catalyzed Friedel–Crafts reactions – How the chiral phosphoric acid regains the proton
|
Liu, Chunhui
|
|
2014
|
1050 |
C |
p. 39-45
7 p.
|
artikel
|
| 12 |
Theoretical investigation of the effect of the solvent, hydrogen bond and amino group on the isomerization of Rhodamines
|
Zhao, Wenwei
|
|
2014
|
1050 |
C |
p. 1-6
6 p.
|
artikel
|
| 13 |
Theoretical studies on the redox stimulated intramolecular isomerization in [Ru(pic)(tpy)(dmso)]+
|
Li, Huifang
|
|
2014
|
1050 |
C |
p. 46-50
5 p.
|
artikel
|
| 14 |
Theoretical study of interaction of amide molecules with kaolinite
|
Song, Kai-Hui
|
|
2014
|
1050 |
C |
p. 58-67
10 p.
|
artikel
|
Tijdschrift beschrijving