| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A combined X-ray scattering and simulation study of halothane in membranes at raised pressures
|
McCarthy, N.L.C.
|
|
2017
|
671 |
C |
p. 21-27
|
artikel
|
| 2 |
A comparative DFT study of interactions of Au and small gold clusters Aun (n=2–4) with CH3S and CH2 radicals
|
Blaško, Martin
|
|
2017
|
671 |
C |
p. 84-91
|
artikel
|
| 3 |
All-boron fullerene exhibits a strong affinity to inorganic anions
|
Colherinhas, Guilherme
|
|
2017
|
671 |
C |
p. 107-112
|
artikel
|
| 4 |
A new rate equation for desorption at the solid/solution interface
|
Bashiri, Hadis
|
|
2017
|
671 |
C |
p. 1-6
|
artikel
|
| 5 |
Comments on “Entransy analysis and optimization of performance of nano-scale irreversible Otto cycle operating with Maxwell-Boltzmann ideal gas”
|
Awad, M.M.
|
|
2017
|
671 |
C |
p. 56-57
|
artikel
|
| 6 |
Computational prediction of the pKas of small peptides through Conceptual DFT descriptors
|
Frau, Juan
|
|
2017
|
671 |
C |
p. 138-141
|
artikel
|
| 7 |
Contents
|
|
|
2017
|
671 |
C |
p. iii-x
|
artikel
|
| 8 |
Cycle of charge carrier states with formation and extinction of a floating gate in an ambipolar tetracyanoquaterthienoquinoid-based field-effect transistor
|
Itoh, Takuro
|
|
2017
|
671 |
C |
p. 71-77
|
artikel
|
| 9 |
Dynamics of ions in a water drop using the AMOEBA polarizable force field
|
Thaunay, Florian
|
|
2017
|
671 |
C |
p. 131-137
|
artikel
|
| 10 |
Editorial Board
|
|
|
2017
|
671 |
C |
p. IFC
|
artikel
|
| 11 |
Electronic states and spectroscopic parameters of selenium monoiodide, SeI: A theoretical contribution
|
Belinassi, Antonio Ricardo
|
|
2017
|
671 |
C |
p. 78-83
|
artikel
|
| 12 |
Fast pulling of ligand approach for the design of β-secretase 1 inhibitors
|
Truong, Duc Toan
|
|
2017
|
671 |
C |
p. 142-146
|
artikel
|
| 13 |
Functionalization of benzene by superhalogens
|
Srivastava, Ambrish Kumar
|
|
2017
|
671 |
C |
p. 44-48
|
artikel
|
| 14 |
Healing of a carbon-vacancy defect in silicon carbide nanotubes by CO molecules: A DFT study
|
Esrafili, Mehdi D.
|
|
2017
|
671 |
C |
p. 49-55
|
artikel
|
| 15 |
Influence of protein crowder size on hydration structure and dynamics in macromolecular crowding
|
Wang, Po-hung
|
|
2017
|
671 |
C |
p. 63-70
|
artikel
|
| 16 |
MRCI+Q calculations on spectroscopic properties of excited states of PbH including spin-orbit coupling
|
Zhao, Shutao
|
|
2017
|
671 |
C |
p. 92-99
|
artikel
|
| 17 |
On the existence of a scattering pre-peak in the mono-ols and diols
|
Poz̆ar, Martina
|
|
2017
|
671 |
C |
p. 37-43
|
artikel
|
| 18 |
PEG encapsulated by porous triamide-linked polymers as support for solid-liquid phase change materials for energy storage
|
Andriamitantsoa, Radoelizo S.
|
|
2017
|
671 |
C |
p. 165-173
|
artikel
|
| 19 |
Performance of glucose/O2 enzymatic fuel cell based on supporting electrodes over-coated by polymer-nanogold particle composite with entrapped enzymes
|
Huo, W.S.
|
|
2017
|
671 |
C |
p. 15-20
|
artikel
|
| 20 |
Prediction of a new ice clathrate with record low density: A potential candidate as ice XIX in guest-free form
|
Huang, Yingying
|
|
2017
|
671 |
C |
p. 186-191
|
artikel
|
| 21 |
Presentation of the PyDEF post-treatment Python software to compute publishable charts for defect energy formation
|
Péan, Emmanuel
|
|
2017
|
671 |
C |
p. 124-130
|
artikel
|
| 22 |
Rate theory on water exchange in aqueous uranyl ion
|
Dang, Liem X.
|
|
2017
|
671 |
C |
p. 58-62
|
artikel
|
| 23 |
Selectivity for CO2 over CH4 on a functionalized periodic mesoporous phenylene-silica explained by transition state theory
|
Kunkel, Christian
|
|
2017
|
671 |
C |
p. 161-164
|
artikel
|
| 24 |
Shape-controlled synthesis of Cu2O nanocrystals by one pot solution-phase reduction process
|
Zhang, Meili
|
|
2017
|
671 |
C |
p. 154-160
|
artikel
|
| 25 |
Solvent-dependent absorption and electronic relaxation dynamics of iron (III) tetra-4-N-methylpyridylporphine
|
Williams, Lenzi J.
|
|
2017
|
671 |
C |
p. 100-106
|
artikel
|
| 26 |
Spin-orbit effects on magnetically induced current densities in the M 4 2 - ( M = B , Al , Ga , In , Tl ) clusters
|
Alvarez-Thon, Luis
|
|
2017
|
671 |
C |
p. 118-123
|
artikel
|
| 27 |
Studies of solvation behaviour of LiI prevailing in diverse solvent systems conductometrically and spectrometrically supported by ab initio technique
|
Das, Koyeli
|
|
2017
|
671 |
C |
p. 7-14
|
artikel
|
| 28 |
Synthesis of Ibuprofen intermediate using alcoholic silver nanoparticles and its kinetics: A greener approach towards drug synthesis
|
Pawar, Sandeep J.
|
|
2017
|
671 |
C |
p. 147-153
|
artikel
|
| 29 |
Thermodynamics and binding mode of novel structurally related 1,2,4-thiadiazole derivatives with native and modified cyclodextrins
|
Terekhova, Irina V.
|
|
2017
|
671 |
C |
p. 28-36
|
artikel
|
| 30 |
The saturable absorption and reverse saturable absorption properties of Cu doped zinc oxide thin films
|
Yao, Cheng-Bao
|
|
2017
|
671 |
C |
p. 113-117
|
artikel
|
| 31 |
Transport coefficients of normal liquid helium-4 calculated by path integral centroid molecular dynamics simulation
|
Imaoka, Haruna
|
|
2017
|
671 |
C |
p. 174-181
|
artikel
|
| 32 |
Velocity map ion imaging study of Ar2 + photodissociation
|
Maner, J.A.
|
|
2017
|
671 |
C |
p. 182-185
|
artikel
|
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