| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A comparison of different water models for melting point calculation of methane hydrate using molecular dynamics simulations
|
Choudhary, Nilesh
|
|
|
516 |
C |
p. 6-14
|
artikel
|
| 2 |
A fragment-based approach to evaluate the performance of AMOEBA polarizable force field on charge-carrier electronic polarization
|
Zhao, Xiaobo
|
|
|
516 |
C |
p. 84-91
|
artikel
|
| 3 |
Analysis of the thermal fluctuations in inclusion complexes of genistein with β-cyclodextrin derivatives
|
Venuti, Valentina
|
|
|
516 |
C |
p. 125-131
|
artikel
|
| 4 |
Anharmonic effect of the reactions related to cyano radical as reactant in fuel combustion mechanism
|
Zhao, Rui
|
|
|
516 |
C |
p. 38-47
|
artikel
|
| 5 |
A nonvolatile organic resistive switching memory based on lotus leaves
|
Qi, Yiming
|
|
|
516 |
C |
p. 168-174
|
artikel
|
| 6 |
Blue-Green-Black phosphorene allotropes conversion: Energetically easy and potentially promising
|
Maatallah, Mohamed
|
|
|
516 |
C |
p. 103-107
|
artikel
|
| 7 |
Can the equilibrium interfacial tensions be more in magnitude than non-equilibrium ones? Comment on “Electrocapillarity and zero-frequency differential capacitance at the interface between mercury and ionic liquids measured using the pendant drop method” by N. Nishi et al. [Phys. Chem. Chem. Phys., 2015, 17, 5219]
|
Kadis, Rouvim
|
|
|
516 |
C |
p. 175-176
|
artikel
|
| 8 |
Computational study on the O- and Cl-loss dissociations of ClOO
|
Meng, Qingyong
|
|
|
516 |
C |
p. 206-212
|
artikel
|
| 9 |
Confinement synthesis of hierarchical ordered macro-/mesoporous TiO2 nanostructures with high crystallization for photodegradation
|
Wang, Ruicong
|
|
|
516 |
C |
p. 48-54
|
artikel
|
| 10 |
DFT prediction of band gap in organic-inorganic metal halide perovskites: An exchange-correlation functional benchmark study
|
Hernández-Haro, Noemí
|
|
|
516 |
C |
p. 225-231
|
artikel
|
| 11 |
Editorial Board
|
|
|
|
516 |
C |
p. ii
|
artikel
|
| 12 |
Effects of surface rates for the series reaction A → B → C on successive separated spherical sites
|
Strieder, William
|
|
|
516 |
C |
p. 160-167
|
artikel
|
| 13 |
Force induced removal of an encapsulated semi-flexible polymer from single walled carbon nanotube
|
Kumar, Sunil
|
|
|
516 |
C |
p. 22-27
|
artikel
|
| 14 |
Glutathione influence on the photoluminescence from semiconducting single-walled carbon nanotubes compared with other thiol compounds
|
Kurnosov, N.V.
|
|
|
516 |
C |
p. 218-224
|
artikel
|
| 15 |
Graphical abstract TOC
|
|
|
|
516 |
C |
p. IBC
|
artikel
|
| 16 |
Graphical abstract TOC
|
|
|
|
516 |
C |
p. OBC
|
artikel
|
| 17 |
Influence of molecular shape on self-diffusion under severe confinement: A molecular dynamics study
|
Dhiman, I.
|
|
|
516 |
C |
p. 92-102
|
artikel
|
| 18 |
Influence of temperature on the swelling pressure of bentonite clay
|
Akinwunmi, Bukunmi
|
|
|
516 |
C |
p. 177-181
|
artikel
|
| 19 |
In situ surface-enhanced Raman spectroscopy study of thiocyanate ions adsorbed on silver nanoparticles under high pressure
|
Wang, Pan
|
|
|
516 |
C |
p. 1-5
|
artikel
|
| 20 |
Luminescence of ND radicals during the destruction of molecular nitrogen nanoclusters
|
McColgan, Patrick T.
|
|
|
516 |
C |
p. 33-37
|
artikel
|
| 21 |
Modulation of electronic properties of monolayer InSe through strain and external electric field
|
Khoa, Doan Q.
|
|
|
516 |
C |
p. 213-217
|
artikel
|
| 22 |
Molecular analysis of selective gas adsorption within composites of ionic polyimides and ionic liquids as gas separation membranes
|
Abedini, Asghar
|
|
|
516 |
C |
p. 71-83
|
artikel
|
| 23 |
Molecular dynamics study of the thermal conductivity in nanofluids
|
Topal, I.
|
|
|
516 |
C |
p. 147-151
|
artikel
|
| 24 |
New hybrid cluster-continuum model for pKa values calculations: Case study of neurotransmitters’ amino group acidity
|
Ristić, Miroslav M.
|
|
|
516 |
C |
p. 55-62
|
artikel
|
| 25 |
Patch clamp data driven stochastic modeling and simulation of hTREK1 potassium ion channel gating
|
Metri, Vishal
|
|
|
516 |
C |
p. 182-190
|
artikel
|
| 26 |
Plasma-chemical processes under high-power gyrotron’s discharge in the mixtures of metal and dielectric powders
|
Akhmadullina, N.S.
|
|
|
516 |
C |
p. 63-70
|
artikel
|
| 27 |
Prediction of efficient promoter molecules of sH hydrogen hydrate: An ab initio study
|
Liu, Jinxiang
|
|
|
516 |
C |
p. 15-21
|
artikel
|
| 28 |
Synthesis, characterization, optical and magnetic properties of pure and Mn, Fe and Zn doped NiO nanoparticles
|
Al Boukhari, J.
|
|
|
516 |
C |
p. 116-124
|
artikel
|
| 29 |
Ternary NiCoP urchin like 3D nanostructure supported on nickel foam as a catalyst for hydrogen generation of alkaline NaBH4
|
Pornea, Arni M.
|
|
|
516 |
C |
p. 152-159
|
artikel
|
| 30 |
The dependence of hydrophobic interactions on solute size
|
Sun, Q.
|
|
|
516 |
C |
p. 199-205
|
artikel
|
| 31 |
Theoretical studies of strong-field photoionization of CH3I
|
Shi, Fan
|
|
|
516 |
C |
p. 28-32
|
artikel
|
| 32 |
Theoretical studies on 4H-cyclopenta[2,1-b:3,4-b′]dithiophene-based Windmill-shaped nanogrids with low reorganization energies
|
Yang, Lei
|
|
|
516 |
C |
p. 191-198
|
artikel
|
| 33 |
Theoretical study of electronic properties and isotope effects in the UV absorption spectrum of disulfur
|
Sarka, Karolis
|
|
|
516 |
C |
p. 108-115
|
artikel
|
| 34 |
Two-phase interface-facilitated synthesis of graphene-like carbon nanosheets and their interfacial assembly behaviors
|
Gao, Hongyi
|
|
|
516 |
C |
p. 132-138
|
artikel
|
| 35 |
Utilization of ultra-light carbon foams for the purification of emulsified oil wastewater and their adsorption kinetics
|
Yang, Shuang
|
|
|
516 |
C |
p. 139-146
|
artikel
|
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