| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Adsorption and dissociation of methanol on defective rutile TiO2 (110) surface with bridging oxygen-vacancy pairs
|
Shi, Hui
|
|
2013
|
584 |
C |
p. 98-102
5 p.
|
artikel
|
| 2 |
A phenothiazine–diketopyrrolopyrrole polymer: Synthesis and photovoltaic applications
|
Jang, Wooree
|
|
2013
|
584 |
C |
p. 119-123
5 p.
|
artikel
|
| 3 |
Chair like NiAu6: Clusters assemblies and CO oxidation study by ab initio methods
|
Nigam, Sandeep
|
|
2013
|
584 |
C |
p. 108-112
5 p.
|
artikel
|
| 4 |
Comparative assessment of density functionals for excited-state dipole moments
|
Bednarska, Joanna
|
|
2013
|
584 |
C |
p. 58-62
5 p.
|
artikel
|
| 5 |
Contents
|
|
|
2013
|
584 |
C |
p. iii-xii
nvt p.
|
artikel
|
| 6 |
Corrigendum to “Thermodynamic and kinetic competition in silver dendrite growth” [Chem. Phys. Lett. 439 (2007) 204]
|
Fang, Jixiang
|
|
2013
|
584 |
C |
p. 200-
1 p.
|
artikel
|
| 7 |
CVD synthesis of mono- and few-layer graphene using alcohols at low hydrogen concentration and atmospheric pressure
|
Campos-Delgado, Jessica
|
|
2013
|
584 |
C |
p. 142-146
5 p.
|
artikel
|
| 8 |
Development of non-standard arginine residue parameters for use with the AMBER force fields
|
Wu, Min
|
|
2013
|
584 |
C |
p. 188-194
7 p.
|
artikel
|
| 9 |
Editorial Board
|
|
|
2013
|
584 |
C |
p. IFC-
1 p.
|
artikel
|
| 10 |
Effects of surface dopants on graphene folding by molecular simulations
|
Becton, Matthew
|
|
2013
|
584 |
C |
p. 135-141
7 p.
|
artikel
|
| 11 |
Enhanced thermoelectric properties and layered structure of Sb2Te3 films induced by special (00 l) crystal plane
|
Tan, Ming
|
|
2013
|
584 |
C |
p. 159-164
6 p.
|
artikel
|
| 12 |
Fe+3 ion induced protein gelation: Small-angle neutron scattering study
|
Kundu, Sarathi
|
|
2013
|
584 |
C |
p. 172-176
5 p.
|
artikel
|
| 13 |
Femtosecond time-resolved laser desorption/ionization mass spectrometry of perylene crystals using Raman-induced vibrational excitation
|
Minegishi, Yuuki
|
|
2013
|
584 |
C |
p. 14-17
4 p.
|
artikel
|
| 14 |
Fluorescent recognition of Fe3+ ion with photoinduced electron transfer (PET) sensor
|
Fegade, Umesh
|
|
2013
|
584 |
C |
p. 165-171
7 p.
|
artikel
|
| 15 |
Folding dynamics of flavin adenine dinucleotide (FAD) inside non-aqueous and aqueous reverse micelles
|
Sengupta, Abhigyan
|
|
2013
|
584 |
C |
p. 67-73
7 p.
|
artikel
|
| 16 |
Heats of formation and thermochemical parameters of small silicon clusters and their ions, Si n + / 0 / - with n =2–13
|
Tam, Nguyen Minh
|
|
2013
|
584 |
C |
p. 147-154
8 p.
|
artikel
|
| 17 |
Hybrid graphene electrodes for supercapacitors of high energy density
|
Zhang, Feifei
|
|
2013
|
584 |
C |
p. 124-129
6 p.
|
artikel
|
| 18 |
Hydrogen bonding interaction between HO2 radical and selected organic acids, RCOOH (R=CH3, H, Cl and F)
|
Joshi, Ravi
|
|
2013
|
584 |
C |
p. 43-48
6 p.
|
artikel
|
| 19 |
Hydrogen release from systems containing phosphine, borane, alane and galane: A mechanistic study
|
Nguyen, Vinh Son
|
|
2013
|
584 |
C |
p. 30-36
7 p.
|
artikel
|
| 20 |
Molecular probe dynamics and free volume in glass-formers: 1,2- and 1,4-poly(butadiene)s
|
Bartoš, J.
|
|
2013
|
584 |
C |
p. 88-92
5 p.
|
artikel
|
| 21 |
Observation of equilibrium liquid–liquid transition in triphenyl phosphite
|
Terashima, Y.
|
|
2013
|
584 |
C |
p. 93-97
5 p.
|
artikel
|
| 22 |
On spectral quadrature for linear-scaling Density Functional Theory
|
Suryanarayana, Phanish
|
|
2013
|
584 |
C |
p. 182-187
6 p.
|
artikel
|
| 23 |
Organic bulk heterojunction photovoltaic devices incorporating 2D arrays of cuboidal silver nanoparticles: Enhanced performance
|
Leonard, Kwati
|
|
2013
|
584 |
C |
p. 130-134
5 p.
|
artikel
|
| 24 |
Parallel low-memory quasi-Newton optimization algorithm for molecular structure
|
Klemsa, Jakub
|
|
2013
|
584 |
C |
p. 10-13
4 p.
|
artikel
|
| 25 |
Polymorphs of 1,1-diamino-2,2-dinitroethene (FOX-7): Isothermal compression versus isobaric heating
|
Dreger, Z.A.
|
|
2013
|
584 |
C |
p. 83-87
5 p.
|
artikel
|
| 26 |
Potential energy function for HeS+ and transport properties of S+ in He
|
Jalili, Amir H.
|
|
2013
|
584 |
C |
p. 49-52
4 p.
|
artikel
|
| 27 |
Raman study of 2,7-bis(biphenyl-4-yl-)2′,7′-ditertbutyl-9,9′-spirobifluorene adsorbed on oxide surfaces
|
Stähler, Julia
|
|
2013
|
584 |
C |
p. 74-78
5 p.
|
artikel
|
| 28 |
Shock tube measurements of the rate constant for the reaction cyclohexene→ethylene+1,3-butadiene
|
Stranic, Ivo
|
|
2013
|
584 |
C |
p. 18-23
6 p.
|
artikel
|
| 29 |
Spectroscopic identification of isomeric jet-cooled benzyl-type radicals formed from 3-fluoro-o-xylene by corona discharge
|
Yoon, Young Wook
|
|
2013
|
584 |
C |
p. 37-42
6 p.
|
artikel
|
| 30 |
Spectroscopic study on the B ̃ 2 A ″ - X ̃ 2 A ″ transition of the trans-2-methylvinoxy radical
|
Kawachi, Ryosuke
|
|
2013
|
584 |
C |
p. 53-57
5 p.
|
artikel
|
| 31 |
Surveying a complex potential energy landscape: Overcoming broken ergodicity using basin-sampling
|
Wales, David J.
|
|
2013
|
584 |
C |
p. 1-9
9 p.
|
artikel
|
| 32 |
The cage fragmentation of doubly ionized norbornane: A Born-Oppenheimer molecular dynamics study
|
Knippenberg, S.
|
|
2013
|
584 |
C |
p. 24-29
6 p.
|
artikel
|
| 33 |
The isothermal oscillations and fluctuation-driven oscillations of N2O decomposition over Cu-ZSM-5 zeolites
|
Liu, Fuliang
|
|
2013
|
584 |
C |
p. 195-199
5 p.
|
artikel
|
| 34 |
Theoretical study on the ionization of aniline in aqueous solutions
|
Matsumura, Yoshihiro
|
|
2013
|
584 |
C |
p. 103-107
5 p.
|
artikel
|
| 35 |
Thermal phase behavior of 1-butyl-3-methylimidazolium hexafluorophosphate: Simultaneous measurements of the melting of two polymorphic crystals by Raman spectroscopy and calorimetry
|
Endo, Takatsugu
|
|
2013
|
584 |
C |
p. 79-82
4 p.
|
artikel
|
| 36 |
The structural and electronic properties of (10,0) zigzag Single-Wall Carbon Nanotubes modified by thiophene groups
|
Hamadanian, Masood
|
|
2013
|
584 |
C |
p. 177-181
5 p.
|
artikel
|
| 37 |
Vibronically induced activation mechanism in photocatalysis of highly dispersed vanadium oxide supported on silica, V2O5/SiO2: Evidence in phosphorescence spectra
|
Iwahara, Naoya
|
|
2013
|
584 |
C |
p. 63-66
4 p.
|
artikel
|
| 38 |
Visualization of conduction pathways in lithium superionic conductors: Li2S-P2S5 glasses and Li7P3S11 glass–ceramic
|
Mori, Kazuhiro
|
|
2013
|
584 |
C |
p. 113-118
6 p.
|
artikel
|
| 39 |
Wet chemical growth of ultra-long ZnO nanoplates and their optical property
|
Samanta, Pijus Kanti
|
|
2013
|
584 |
C |
p. 155-158
4 p.
|
artikel
|
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