| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A DFT study of the electronic structures and optical properties of (Cr, C) co-doped rutile TiO2
|
Chen, Hao
|
|
2018
|
501 |
C |
p. 60-67
|
artikel
|
| 2 |
Adsorption studies of trimethyl amine and n-butyl amine vapors on stanene nanotube molecular device – A first-principles study
|
Bhuvaneswari, R.
|
|
2018
|
501 |
C |
p. 78-85
|
artikel
|
| 3 |
A molecular electron density theory study of the chemo- and regioselective [3 + 2] cycloaddition reactions between trifluoroacetonitrile N-oxide and thioketones
|
Emamian, Saeedreza
|
|
2018
|
501 |
C |
p. 128-137
|
artikel
|
| 4 |
Analysis of paramagnetic 3d ions (Cr3+ and Fe3+) centers in fluoroelpasolite Cs2NaGaF6 crystal by both DFT and SPM calculations
|
Erbahar, D.
|
|
2018
|
501 |
C |
p. 93-100
|
artikel
|
| 5 |
Complementary experimental-simulational study of surfactant micellar phase in the extraction process of metallic ions: Effects of temperature and salt concentration
|
Soto-Ángeles, Alan Gustavo
|
|
2018
|
501 |
C |
p. 15-25
|
artikel
|
| 6 |
Corrigendum to “Theoretical and experimental investigation of Electron Transfer Mediated Decay in ArKr clusters” [Chem. Phys. 482 (2017) 226–238]
|
Fasshauer, Elke
|
|
2018
|
501 |
C |
p. 138
|
artikel
|
| 7 |
Editorial Board
|
|
|
2018
|
501 |
C |
p. ii
|
artikel
|
| 8 |
Graphical abstract TOC
|
|
|
2018
|
501 |
C |
p. OBC
|
artikel
|
| 9 |
Graphical abstract TOC
|
|
|
2018
|
501 |
C |
p. II-IV
|
artikel
|
| 10 |
Graphical abstract TOC
|
|
|
2018
|
501 |
C |
p. IBC
|
artikel
|
| 11 |
Influence of acceptor on charge mobility in stacked π-conjugated polymers
|
Sun, Shih-Jye
|
|
2018
|
501 |
C |
p. 8-14
|
artikel
|
| 12 |
Insight into the new excited-state intramolecular proton transfer (ESIPT) mechanism of N,N′-bis(salicylidene)-p-phenylenediamine (p-BSP)
|
Hao, Jiaojiao
|
|
2018
|
501 |
C |
p. 53-59
|
artikel
|
| 13 |
Isosteric heat of water adsorption and desorption in homoionic alkaline-earth montmorillonites
|
Belhocine, M.
|
|
2018
|
501 |
C |
p. 26-34
|
artikel
|
| 14 |
Monolayer adsorption of noble gases on graphene
|
Maiga, Sidi M.
|
|
2018
|
501 |
C |
p. 46-52
|
artikel
|
| 15 |
6.2 μm spectrum and 6-dimensional morphed potentials of OC-H2O
|
Rivera-Rivera, Luis A.
|
|
2018
|
501 |
C |
p. 35-45
|
artikel
|
| 16 |
On the solvation of hydronium by carbon dioxide: Structural and infrared spectroscopic study of (H3O+)(CO2) n
|
Yang, Jianpeng
|
|
2018
|
501 |
C |
p. 1-7
|
artikel
|
| 17 |
Reaction mechanism and kinetics of the degradation of terbacil initiated by OH radical – A theoretical study
|
Ponnusamy, S.
|
|
2018
|
501 |
C |
p. 110-120
|
artikel
|
| 18 |
Recognition of anions using urea and thiourea substituted calixarenes: A density functional theory study of non-covalent interactions
|
Athar, Mohd
|
|
2018
|
501 |
C |
p. 68-77
|
artikel
|
| 19 |
Stark shift of impurity doped quantum dots: Role of noise
|
Arif, Sk. Md.
|
|
2018
|
501 |
C |
p. 101-109
|
artikel
|
| 20 |
Stretched-to-compressed-exponential crossover observed in the electrical degradation kinetics of some spinel-metallic screen-printed structures
|
Balitska, V.
|
|
2018
|
501 |
C |
p. 121-127
|
artikel
|
| 21 |
The role of near resonance electronic energy transfer on the collisional quenching of NO (A2Σ+) by C6H6 and C6F6 at low temperature
|
Winner, Joshua D.
|
|
2018
|
501 |
C |
p. 86-92
|
artikel
|
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