| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio kinetics for isomerization reaction of normal-chain hexadiene isomers
|
Yang, Feiyu
|
|
2016
|
663 |
C |
p. 66-73
8 p.
|
artikel
|
| 2 |
A DFT study on NEA GaN photocathode with an ultrathin n-type Si-doped GaN cap layer
|
Xia, Sihao
|
|
2016
|
663 |
C |
p. 90-96
7 p.
|
artikel
|
| 3 |
A push-pull organic dye with a quinoidal thiophene linker: Photophysical properties and solvent effects
|
Climent, Clàudia
|
|
2016
|
663 |
C |
p. 45-50
6 p.
|
artikel
|
| 4 |
A three-ions model of electrodiffusion kinetics in a nanochannel
|
Sebechlebská, Táňa
|
|
2016
|
663 |
C |
p. 33-39
7 p.
|
artikel
|
| 5 |
Bubble nucleation in a Lennard-Jones binary liquid mixture
|
Baidakov, Vladimir G.
|
|
2016
|
663 |
C |
p. 57-60
4 p.
|
artikel
|
| 6 |
Can two H2 molecules be inserted into C60 – an accurate first-principles exploration of structural, energetic and vibrational properties of the 2H2@C60 complex
|
Dolgonos, Grygoriy A.
|
|
2016
|
663 |
C |
p. 104-110
7 p.
|
artikel
|
| 7 |
Conduction quantization in monolayer MoS2
|
Li, T.S.
|
|
2016
|
663 |
C |
p. 40-44
5 p.
|
artikel
|
| 8 |
Contents
|
|
|
2016
|
663 |
C |
p. iii-ix
nvt p.
|
artikel
|
| 9 |
Defect-induced Raman spectroscopy in single-layer graphene with boron and nitrogen substitutional defects by theoretical investigation
|
Jiang, Jie
|
|
2016
|
663 |
C |
p. 79-83
5 p.
|
artikel
|
| 10 |
Editorial Board
|
|
|
2016
|
663 |
C |
p. IFC-
1 p.
|
artikel
|
| 11 |
Efficient spirobifluorene-core electron-donor material for application in solution-processed organic solar cells
|
Nazim, M.
|
|
2016
|
663 |
C |
p. 137-144
8 p.
|
artikel
|
| 12 |
Ground-state dipole moment of the spatially confined carbon monoxide and boron fluoride molecules
|
Chołuj, Marta
|
|
2016
|
663 |
C |
p. 84-89
6 p.
|
artikel
|
| 13 |
Hydrolysis mechanism of anticancer drug lobaplatin in aqueous medium under neutral and acidic conditions: A DFT study
|
Reddy B., Venkata P.
|
|
2016
|
663 |
C |
p. 115-122
8 p.
|
artikel
|
| 14 |
Kinetics of enzyme-mediated hydrolysis of lipid vesicles
|
Zhdanov, Vladimir P.
|
|
2016
|
663 |
C |
p. 51-56
6 p.
|
artikel
|
| 15 |
New mechanisms of macroion-induced disintegration of charged droplets
|
Consta, Styliani
|
|
2016
|
663 |
C |
p. 1-12
12 p.
|
artikel
|
| 16 |
Oxygen reduction reaction on nitrogen-doped graphene nanoribbons: A density functional theory study
|
Hou, Xiuli
|
|
2016
|
663 |
C |
p. 123-127
5 p.
|
artikel
|
| 17 |
Quantum chemistry insight into Mg-substitution in chlorophyll by toxic heavy metals: Cd, Hg and Pb
|
Bechaieb, Rim
|
|
2016
|
663 |
C |
p. 27-32
6 p.
|
artikel
|
| 18 |
Rectifying enhancement induced by conjugation breaking in thiolated arylethynylene single-molecular diodes
|
Zuo, Xi
|
|
2016
|
663 |
C |
p. 74-78
5 p.
|
artikel
|
| 19 |
Relativistic frozen core potential scheme with relaxation of core electrons
|
Nakajima, Yuya
|
|
2016
|
663 |
C |
p. 97-103
7 p.
|
artikel
|
| 20 |
Structural transition of (InSb)n clusters at n=6–10
|
Lu, Qi Liang
|
|
2016
|
663 |
C |
p. 128-132
5 p.
|
artikel
|
| 21 |
Structure and internal dynamics of n-propyl acetate studied by microwave spectroscopy and quantum chemistry
|
Sutikdja, Lilian W.
|
|
2016
|
663 |
C |
p. 145-149
5 p.
|
artikel
|
| 22 |
Super-microporous solid base MgO-ZrO2 composite and their application in biodiesel production
|
Su, Jiaojiao
|
|
2016
|
663 |
C |
p. 61-65
5 p.
|
artikel
|
| 23 |
Surface-enhanced infrared absorption studies of copper nanostructures formed by oblique-angle deposition
|
Henry, William A.
|
|
2016
|
663 |
C |
p. 111-114
4 p.
|
artikel
|
| 24 |
The field–dependent interface recombination velocity for organic–inorganic heterojunction
|
Szmytkowski, Jędrzej
|
|
2016
|
663 |
C |
p. 13-15
3 p.
|
artikel
|
| 25 |
The NbN C 3Π−X 3Δ (1–0) band: Experimental and theoretical study of the spin-orbit interaction between the C 3Π and e 1Π states
|
Bhattacharyya, Soumen
|
|
2016
|
663 |
C |
p. 133-136
4 p.
|
artikel
|
| 26 |
Theoretical study of the thermochemistry of chlorine oxyfluorides
|
Sánchez, Hernán R.
|
|
2016
|
663 |
C |
p. 16-20
5 p.
|
artikel
|
| 27 |
Tunnel magnetoresistance of diamondoids
|
Matsuura, Yukihito
|
|
2016
|
663 |
C |
p. 21-26
6 p.
|
artikel
|
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