| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio chemical kinetics for hypergolic reactions of nitrogen tetroxide with hydrazine and methyl hydrazine
|
Huyen, Trinh Le
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 2 |
A DFT study on second-order NLO properties of bis-cyclometalated Iridium(III) complexes with chelating dicarbene auxiliary ligands
|
Shen, Yang
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 3 |
A DFT/TDDFT investigation on structure–photophysical properties relationship of phenothiazine derivatives with substitutions on C-3/N-10 sites
|
Lu, Yongqiang
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 4 |
Adsorption behavior of cytosine and guanine nucleobases on graphyne nanosheets: A DFT study
|
Madhumitha, S.
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 5 |
Comparative DFT study on the platinum catalyzed [3 + 2] and [2 + 2] cycloaddition reactions between the derivatives of allene and alkene
|
Saha, Rohini
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 6 |
Computational studies on the reactions of the peroxy radical CF3OCH2O2 with HO2 and NO
|
Salta, Zoi
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 7 |
Density functional theory study of structural, electronic and CO adsorption properties of anionic Scn − (n = 2–13) clusters
|
Sajjad, Saira
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 8 |
Editorial Board
|
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 9 |
Highly selective acridinium based cyanine dyes for the detection of DNA base pairs (adenine, cytosine, guanine and thymine)
|
Sajid, Hasnain
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 10 |
Ionization dynamics of Ne-doped helium clusters at low temperature: Ring-polymer molecular dynamics simulations including electronically nonadiabatic transitions
|
Miyazaki, Takaaki
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 11 |
The dataset of covalent bond lengths resulting from the first-principle calculations
|
Nikolaienko, Tymofii Yu.
|
|
2019
|
1163 |
C |
p.
|
artikel
|
| 12 |
Theoretical study on boron-nitrogen containing analogues of 6,6,18-graphdiyne
|
Shi, Chenna
|
|
2019
|
1163 |
C |
p.
|
artikel
|
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