| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio study of the low-lying electronic states of [Be–Kr]+
|
Niu, Xianghong
|
|
2015
|
619 |
C |
p. 208-213
|
artikel
|
| 2 |
A new variation of the Buckingham exponential-6 potential with a tunable, singularity-free short-range repulsion and an adjustable long-range attraction
|
Werhahn, Jasper C.
|
|
2015
|
619 |
C |
p. 133-138
|
artikel
|
| 3 |
Anion photoelectron spectroscopy and high level ab initio calculations of the halide–acetylene dimer complexes
|
Beckham, D.A.R.
|
|
2015
|
619 |
C |
p. 241-246
|
artikel
|
| 4 |
Blending damped drift of impurity with noise: Impact on off-diagonal components of frequency-dependent linear and nonlinear polarizabilities of quantum dots
|
Ganguly, Jayanta
|
|
2015
|
619 |
C |
p. 49-53
|
artikel
|
| 5 |
Contents
|
|
|
2015
|
619 |
C |
p. iii-xv
|
artikel
|
| 6 |
Corrigendum to “Light-induced, site-selective isomerization of glyoxylic acid in solid xenon” [Chem. Phys. Lett. 616–617 (2014) 91–97]
|
Olbert-Majkut, Adriana
|
|
2015
|
619 |
C |
p. 256
|
artikel
|
| 7 |
Covalent functionalization of single-walled carbon nanotubes through attachment of aromatic diisocyanate molecules from first principles
|
Goclon, Jakub
|
|
2015
|
619 |
C |
p. 103-108
|
artikel
|
| 8 |
Curvature effect of O2 adsorption and dissociation on SiC nanotubes and nanosheet
|
Zhang, Peng
|
|
2015
|
619 |
C |
p. 92-96
|
artikel
|
| 9 |
Determination of conformation and orientation of immobilized peptides and proteins at buried interfaces
|
Shen, Lei
|
|
2015
|
619 |
C |
p. 247-255
|
artikel
|
| 10 |
Editorial Board
|
|
|
2015
|
619 |
C |
p. IFC
|
artikel
|
| 11 |
Effect of double-stranded DNA on electrical double layer structure at oxide/electrolyte interface in classical molecular dynamics simulation
|
Maekawa, Yuki
|
|
2015
|
619 |
C |
p. 152-157
|
artikel
|
| 12 |
Efficient enhancement of internal proton transfer of branched π-extended organic chromophore under one-photon and near-infrared two-photon irradiation
|
Gong, Yulong
|
|
2015
|
619 |
C |
p. 201-207
|
artikel
|
| 13 |
Efficient light-to-current conversion by organic–inorganic interfacial charge-transfer transitions in TiO2 chemically adsorbed with 2-anthroic acid
|
Fujisawa, Jun-ichi
|
|
2015
|
619 |
C |
p. 180-184
|
artikel
|
| 14 |
Electroluminescence from colloidal semiconductor CdSe nanoplatelets in hybrid organic–inorganic light emitting diode
|
Vitukhnovsky, A.G.
|
|
2015
|
619 |
C |
p. 185-188
|
artikel
|
| 15 |
Electromagnetic field redistribution in coupled plasmonic nanoparticle dimer-dielectric substrate system
|
Fang, Yurui
|
|
2015
|
619 |
C |
p. 139-143
|
artikel
|
| 16 |
Experimental confirmation of ground state isotopic isomerization from OC⋯HI to OC⋯ID
|
Scott, Kevin W.
|
|
2015
|
619 |
C |
p. 174-179
|
artikel
|
| 17 |
Experimental determination of the rate constant of the reaction between C2H5O2 and OH radicals
|
Faragó, Eszter P.
|
|
2015
|
619 |
C |
p. 196-200
|
artikel
|
| 18 |
Fabrication of α-Fe2O3 hexagonal disc/SnO2 nanoparticle semiconductor nanoheterostructures and its properties
|
Biju, C.S.
|
|
2015
|
619 |
C |
p. 1-6
|
artikel
|
| 19 |
First principles study on B/P pair and Al/N pair doping carbon nanotubes
|
Huang, Gang
|
|
2015
|
619 |
C |
p. 189-192
|
artikel
|
| 20 |
Following the decay dynamics of photoexcited 1,2,4-trimethylbenzene using femtosecond time-resolved photoelectron imaging
|
Liu, Zhiming
|
|
2015
|
619 |
C |
p. 44-48
|
artikel
|
| 21 |
Further theoretical insight into the reaction mechanism of the hepatitis C NS3/NS4A serine protease
|
Martínez-González, José Ángel
|
|
2015
|
619 |
C |
p. 97-102
|
artikel
|
| 22 |
Hydrogen-bonded aggregates in the mixtures of piperidine with water: Thermodynamic, SANS and theoretical studies
|
Marczak, Wojciech
|
|
2015
|
619 |
C |
p. 77-83
|
artikel
|
| 23 |
Influences of interfacial terminations on electronic structure and magnetoelectric coupling in Fe/KNbO3 superlattices
|
Zhang, Hu
|
|
2015
|
619 |
C |
p. 163-168
|
artikel
|
| 24 |
Intriguing radical–radical interactions among double-electron oxidized adenine–thymine base pairs
|
Wang, Mei
|
|
2015
|
619 |
C |
p. 223-229
|
artikel
|
| 25 |
Ionizing benzene with superhalogens
|
Czapla, Marcin
|
|
2015
|
619 |
C |
p. 32-35
|
artikel
|
| 26 |
Levy–Lieb principle: The bridge between the electron density of Density Functional Theory and the wavefunction of Quantum Monte Carlo
|
Delle Site, Luigi
|
|
2015
|
619 |
C |
p. 148-151
|
artikel
|
| 27 |
Lithium(I) in liquid ammonia: A quantum mechanical charge field (QMCF) molecular dynamics simulation study
|
Prasetyo, Niko
|
|
2015
|
619 |
C |
p. 158-162
|
artikel
|
| 28 |
Mechanism of degradation of electrolyte solutions for dye-sensitized solar cells under ultraviolet light irradiation
|
Nakajima, Shohei
|
|
2015
|
619 |
C |
p. 36-38
|
artikel
|
| 29 |
Molecular spinless energies of the modified Rosen–Morse potential energy model in higher spatial dimensions
|
Jia, Chun-Sheng
|
|
2015
|
619 |
C |
p. 54-60
|
artikel
|
| 30 |
New findings on the influence of carbon surface curvature on energetics of benzene adsorption from aqueous solutions
|
Wiśniewski, Marek
|
|
2015
|
619 |
C |
p. 219-222
|
artikel
|
| 31 |
Novel synthesis and DC electrical studies of polyindole/poly(vinyl acetate) composite films
|
Bhagat, D.J.
|
|
2015
|
619 |
C |
p. 27-31
|
artikel
|
| 32 |
Numerical evaluations of the isotopic shifts and lowest-order QED corrections for the ground 11 S-states of the 3He and 4He atoms
|
Frolov, Alexei M.
|
|
2015
|
619 |
C |
p. 61-65
|
artikel
|
| 33 |
On the fly nodal searches in importance sampled fixed-node diffusion Monte Carlo using a parallel, fine-grained, genetic algorithm
|
Wairegi, Angeline
|
|
2015
|
619 |
C |
p. 71-76
|
artikel
|
| 34 |
On the solid-state NMR spectra of naproxen
|
Czernek, Jiří
|
|
2015
|
619 |
C |
p. 230-235
|
artikel
|
| 35 |
Organic–inorganic lead halide perovskite solar cell materials: A possible stability problem
|
Schoonman, J.
|
|
2015
|
619 |
C |
p. 193-195
|
artikel
|
| 36 |
Photoacoustic calorimetry study of ligand photorelease from the Ru(II)bis(2,2′-bipyridine)(6,6′-dimethyl-2,2′-bipyridine) complex in aqueous solution
|
Word, Tarah A.
|
|
2015
|
619 |
C |
p. 214-218
|
artikel
|
| 37 |
Pressure broadening of transitions in the CH3F ν 4 band using Stark modulated Lamb dips
|
Okabayashi, Yusuke
|
|
2015
|
619 |
C |
p. 144-147
|
artikel
|
| 38 |
Spin conduction in nitroxide molecules
|
Matsuura, Yukihito
|
|
2015
|
619 |
C |
p. 23-26
|
artikel
|
| 39 |
Structures and stabilities of hemi-bonded vs proton-transferred isomers of dimer radical cation systems (XH3 YH3)+ (X,Y=N, P, As)
|
Ji, Li Fei
|
|
2015
|
619 |
C |
p. 115-121
|
artikel
|
| 40 |
Suppression of superradiance from an ensemble of two-level atoms in the presence of foreign gas collisions
|
Manassah, Jamal T.
|
|
2015
|
619 |
C |
p. 84-87
|
artikel
|
| 41 |
Synthesis and improved electrochemical properties of Na-substituted Li2MnSiO4 nanoparticles as cathode materials for Li-ion batteries
|
Wang, Min
|
|
2015
|
619 |
C |
p. 39-43
|
artikel
|
| 42 |
Synthesis and photoluminescence properties of core–shell structured YVO4:Eu3+@SiO2 nanocomposites
|
Liu, Lina
|
|
2015
|
619 |
C |
p. 169-173
|
artikel
|
| 43 |
The ab initio study of halogen and hydrogen σN-bonded para-substituted pyridine⋯(X2/XY/HX) complexes
|
Sladek, Vladimir
|
|
2015
|
619 |
C |
p. 7-13
|
artikel
|
| 44 |
Theoretical investigation of the hydrogen shift reactions in peroxy radicals derived from the atmospheric decomposition of 3-methyl-3-buten-1-ol (MBO331)
|
Knap, Hasse C.
|
|
2015
|
619 |
C |
p. 236-240
|
artikel
|
| 45 |
Theoretical investigations of EPR g factors for Ce3+ ion at monoclinic Cs site in YAlO3 crystal
|
Liu, Hong-Gang
|
|
2015
|
619 |
C |
p. 122-125
|
artikel
|
| 46 |
The performance of RI-MP2 based potential energy surfaces in a vibrational self-consistent field treatment
|
Lutz, Oliver M.D.
|
|
2015
|
619 |
C |
p. 66-70
|
artikel
|
| 47 |
The potential energy surface and microwave spectra of the Xe–CO2 complex
|
Wang, Zhongquan
|
|
2015
|
619 |
C |
p. 14-17
|
artikel
|
| 48 |
The role of long-range van der Waals forces in the relative stability of SiO2-zeolites
|
Román-Román, Erick I.
|
|
2015
|
619 |
C |
p. 109-114
|
artikel
|
| 49 |
The routes of association of (hydro)oxo centers on iron hydroxide at the water oxidation process: DFT predictions
|
Shubin, Aleksandr A.
|
|
2015
|
619 |
C |
p. 126-132
|
artikel
|
| 50 |
Ultrafast chemical kinetics: Elementary chemical act
|
Bratos, S.
|
|
2015
|
619 |
C |
p. 88-91
|
artikel
|
| 51 |
Vacuum ultraviolet photodissociation dynamics of methanol at 121.6nm
|
Lucas, Michael
|
|
2015
|
619 |
C |
p. 18-22
|
artikel
|
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