| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio chemical kinetics for the HCCO+OH reaction
|
Mai, Tam V.-T.
|
|
2014
|
592 |
C |
p. 175-181
7 p.
|
artikel
|
| 2 |
Acoustic and thermal anomalies in a liquid–glass transition of racemic S(+)–R(−) ketoprofen
|
Shibata, Tomohiko
|
|
2014
|
592 |
C |
p. 80-84
5 p.
|
artikel
|
| 3 |
Adiabatic wavepacket dynamics study of the N+NH→N2 +H reaction on the ground-state potential energy surface
|
Yang, Huan
|
|
2014
|
592 |
C |
p. 120-123
4 p.
|
artikel
|
| 4 |
Assessment of SERS activity and enhancement factors for highly sensitive gold coated substrates probed with explosive molecules
|
Botti, Sabina
|
|
2014
|
592 |
C |
p. 277-281
5 p.
|
artikel
|
| 5 |
A study on the aromaticity of [n]phenacenes and [n]helicenes (n =3–9)
|
Kalam, Horigul
|
|
2014
|
592 |
C |
p. 320-325
6 p.
|
artikel
|
| 6 |
A three-dimensional potential energy surface and infrared spectra for the Ar–OCS van der Waals complex
|
Sun, Chunyan
|
|
2014
|
592 |
C |
p. 182-187
6 p.
|
artikel
|
| 7 |
Bacillus spores and their relevant chemicals studied by terahertz time domain spectroscopy
|
Tang, Jianhua
|
|
2014
|
592 |
C |
p. 302-306
5 p.
|
artikel
|
| 8 |
Bandgap opening in silicene: Effect of substrates
|
Gao, N.
|
|
2014
|
592 |
C |
p. 222-226
5 p.
|
artikel
|
| 9 |
Can density functional theory methods be used to simulate the ∊ phase of solid oxygen?
|
Bartolomei, M.
|
|
2014
|
592 |
C |
p. 170-174
5 p.
|
artikel
|
| 10 |
Charge transfer in rare earth oxide hybrid solar cells
|
Fernando, Kasun
|
|
2014
|
592 |
C |
p. 155-159
5 p.
|
artikel
|
| 11 |
Chemical sensitivity of sulfur 1s NEXAFS spectroscopy II: Speciation of disulfide functional groups
|
Behyan, Shirin
|
|
2014
|
592 |
C |
p. 109-113
5 p.
|
artikel
|
| 12 |
Chemical sensitivity of sulfur 1s NEXAFS spectroscopy I: Speciation of sulfoxides and sulfones
|
Behyan, Shirin
|
|
2014
|
592 |
C |
p. 69-74
6 p.
|
artikel
|
| 13 |
Chemistry and structure of BaTiO3 ultra-thin films grown by different O2 plasma power
|
Wang, J.L.
|
|
2014
|
592 |
C |
p. 206-210
5 p.
|
artikel
|
| 14 |
Coherent control of vibrational and rotational molecular motions using double-pulse optical Kerr effect
|
Nikiforov, V.G.
|
|
2014
|
592 |
C |
p. 196-199
4 p.
|
artikel
|
| 15 |
Competitive absorption of Eu3+ and Tb3+codoped in NaGd(PO3)4 phosphors
|
Gu, Jinlan
|
|
2014
|
592 |
C |
p. 261-264
4 p.
|
artikel
|
| 16 |
Contents
|
|
|
2014
|
592 |
C |
p. iii-xx
nvt p.
|
artikel
|
| 17 |
Density functional and multireference ab initio study of the ground and excited states of Ru2
|
Kim, Joonghan
|
|
2014
|
592 |
C |
p. 24-29
6 p.
|
artikel
|
| 18 |
Dynamics of H atom production from photodissociation of H2O2 at 205nm
|
Park, Sung Man
|
|
2014
|
592 |
C |
p. 124-126
3 p.
|
artikel
|
| 19 |
Editorial Board
|
|
|
2014
|
592 |
C |
p. IFC-
1 p.
|
artikel
|
| 20 |
Electric field effects on donor–acceptor dyes: A model compound study using UV/vis absorption and Raman spectroscopy
|
Lasogga, Lars
|
|
2014
|
592 |
C |
p. 1-6
6 p.
|
artikel
|
| 21 |
Elucidation of the indirect H–H interaction in (2×1)-H/Pd(311) and on Pd(111)
|
Shuttleworth, I.G.
|
|
2014
|
592 |
C |
p. 14-17
4 p.
|
artikel
|
| 22 |
Energy versus charge transfer in π-conjugated polymer:fullerene blends
|
Heinrichova, Patricie
|
|
2014
|
592 |
C |
p. 314-319
6 p.
|
artikel
|
| 23 |
EPR characteristics of free radicals in DOPA–melanin–moxifloxacin complexes at ambient level of UVA radiation
|
Beberok, Artur
|
|
2014
|
592 |
C |
p. 41-46
6 p.
|
artikel
|
| 24 |
Facile synthesis of carbon-supported, ultrasmall ruthenium oxide nanocrystals for supercapacitor electrode materials
|
Kang, Nari
|
|
2014
|
592 |
C |
p. 192-195
4 p.
|
artikel
|
| 25 |
Formation of host–guest complexes on gold surface investigated by surface-enhanced IR absorption spectroscopy
|
Inokuchi, Yoshiya
|
|
2014
|
592 |
C |
p. 90-95
6 p.
|
artikel
|
| 26 |
Formation of spiroiminodihydantoin due to the reaction between 8-oxoguanine and carbonate radical anion: A quantum computational study
|
Yadav, Amarjeet
|
|
2014
|
592 |
C |
p. 232-237
6 p.
|
artikel
|
| 27 |
Frozen core potential scheme with a relativistic electronic Hamiltonian: Theoretical connection between the model potential and all-electron treatments
|
Seino, Junji
|
|
2014
|
592 |
C |
p. 341-348
8 p.
|
artikel
|
| 28 |
Gd doped Au nanoclusters: Molecular magnets with novel properties
|
Mokkath, Junais Habeeb
|
|
2014
|
592 |
C |
p. 217-221
5 p.
|
artikel
|
| 29 |
Gold nanoparticles loaded on zeolite as inorganic matrix for laser desorption/ionization mass spectrometry of small molecules
|
Yang, Mengrui
|
|
2014
|
592 |
C |
p. 160-163
4 p.
|
artikel
|
| 30 |
Ground state charge transfer complex formation of some metalloporphyrins with aromatic solvents
|
Ghosh, Mihir
|
|
2014
|
592 |
C |
p. 149-154
6 p.
|
artikel
|
| 31 |
Hole–electron quantum tunnelling interferences through a molecular junction
|
Portais, Mathilde
|
|
2014
|
592 |
C |
p. 272-276
5 p.
|
artikel
|
| 32 |
Hybrid quantum–classical study of the non-adiabatic cis–trans photoisomerization in a model polyatomic molecule
|
Rodríguez-Hernández, F.
|
|
2014
|
592 |
C |
p. 18-23
6 p.
|
artikel
|
| 33 |
Impact of graphene incorporation on the orientational order of graphene/liquid crystal composites
|
Alam, Todd M.
|
|
2014
|
592 |
C |
p. 7-13
7 p.
|
artikel
|
| 34 |
Inorganic acid-catalyzed tautomerization of vinyl alcohol to acetaldehyde
|
Karton, Amir
|
|
2014
|
592 |
C |
p. 330-333
4 p.
|
artikel
|
| 35 |
Interaction between O2 and neutral/charged Au n (n =1–3) clusters: A comparative study between density-functional theory and coupled cluster calculations
|
Zhao, Yu
|
|
2014
|
592 |
C |
p. 127-131
5 p.
|
artikel
|
| 36 |
Inversion-torsional motion in the ethyl radical
|
Kręglewski, Marek
|
|
2014
|
592 |
C |
p. 307-313
7 p.
|
artikel
|
| 37 |
Inverted polymer solar cells with a low-temperature ramp annealed sol–gel derived aluminum-doped ZnO nano-ridge film as a cathode buffer layer
|
Li, Fan
|
|
2014
|
592 |
C |
p. 96-102
7 p.
|
artikel
|
| 38 |
Isotropic to cholesteric phase transition of DNA solutions
|
Mukherjee, Prabir K.
|
|
2014
|
592 |
C |
p. 238-241
4 p.
|
artikel
|
| 39 |
Laser performance parameters of Yb3+ doped UV-transparent phosphate glasses
|
Pinheiro, A.S.
|
|
2014
|
592 |
C |
p. 164-169
6 p.
|
artikel
|
| 40 |
Low formation energy and kinetic barrier of Stone–Wales defect in infinite and finite silicene
|
Manjanath, Aaditya
|
|
2014
|
592 |
C |
p. 52-55
4 p.
|
artikel
|
| 41 |
Low-temperature synthesis of polyethyleneimine-entrapped CdS quantum dots
|
Kosmella, Sabine
|
|
2014
|
592 |
C |
p. 114-119
6 p.
|
artikel
|
| 42 |
Measurement of the Cotton Mouton effect of water vapour
|
Della Valle, F.
|
|
2014
|
592 |
C |
p. 288-291
4 p.
|
artikel
|
| 43 |
Mechanistic study of synthesis of gold nanoparticles using multi-functional polymer
|
Yu, Taekyung
|
|
2014
|
592 |
C |
p. 265-271
7 p.
|
artikel
|
| 44 |
Methane and propane co-conversion study over zinc, molybdenum and gallium modified HZSM-5 catalysts using time-of-flight mass-spectrometry
|
Tian, M.
|
|
2014
|
592 |
C |
p. 36-40
5 p.
|
artikel
|
| 45 |
Molecular photoelectron angular distributions with intense attosecond circularly polarized UV laser pulses
|
Yuan, Kai-Jun
|
|
2014
|
592 |
C |
p. 334-340
7 p.
|
artikel
|
| 46 |
Molecular structure and EPR spectral studies of trans-Bis(perchlorato-κO)tetrakis(1-vinyl-1Himidazole-κN3)copper(II)
|
Küçük, Kamil
|
|
2014
|
592 |
C |
p. 59-63
5 p.
|
artikel
|
| 47 |
Monoclinic to tetragonal phase transition in ZrO2 thin films under swift heavy ion irradiation: Structural and electronic structure study
|
Sharma, Aditya
|
|
2014
|
592 |
C |
p. 85-89
5 p.
|
artikel
|
| 48 |
Multiple transition states and roaming in ion–molecule reactions: A phase space perspective
|
Mauguière, Frédéric A.L.
|
|
2014
|
592 |
C |
p. 282-287
6 p.
|
artikel
|
| 49 |
Nanometer-thick V2O5 sheets on aluminum foil for an additive-free positive electrode of lithium-ion batteries
|
Kikkawa, Jun
|
|
2014
|
592 |
C |
p. 56-58
3 p.
|
artikel
|
| 50 |
NOON states in star-topology spin-systems: Applications in diffusion studies and RF inhomogeneity mapping
|
Shukla, Abhishek
|
|
2014
|
592 |
C |
p. 227-231
5 p.
|
artikel
|
| 51 |
On the stability of the cyclic O8 molecule
|
Ochoa-Calle, A.J.
|
|
2014
|
592 |
C |
p. 326-329
4 p.
|
artikel
|
| 52 |
Photo-induced electron transfer at nanostructured semiconductor–zinc porphyrin interface
|
Hakola, Hanna
|
|
2014
|
592 |
C |
p. 47-51
5 p.
|
artikel
|
| 53 |
Photoluminescence of zirconium hydroxide: Origin of a chemisorption-induced ‘red-stretch’
|
Watters, Evan J.
|
|
2014
|
592 |
C |
p. 297-301
5 p.
|
artikel
|
| 54 |
Quadrupole ion trap/time-of-flight photo-fragmentation spectrometry of the hexa-peri-hexabenzocoronene (HBC) cation
|
Zhen, J.
|
|
2014
|
592 |
C |
p. 211-216
6 p.
|
artikel
|
| 55 |
Quasiclassical trajectory study of energy relaxation process in collision of highly vibrationally excited O2 and ground-state N2
|
Ohkubo, Yasuhiro
|
|
2014
|
592 |
C |
p. 64-68
5 p.
|
artikel
|
| 56 |
Solvation in nanoscale solvophobic confinement near liquid–gas phase coexistence
|
Das, Amit
|
|
2014
|
592 |
C |
p. 256-260
5 p.
|
artikel
|
| 57 |
State-resolved predissociation dynamics of the formyloxyl radical
|
Ray, Amelia W.
|
|
2014
|
592 |
C |
p. 30-35
6 p.
|
artikel
|
| 58 |
Structural and vibrational properties of nitrogen-rich energetic material guanidinium 2-methyl-5-nitraminotetrazolate
|
Ramesh Babu, K.
|
|
2014
|
592 |
C |
p. 132-137
6 p.
|
artikel
|
| 59 |
Structural, energetic and tautomeric properties of the T·T∗/T∗·T DNA mismatch involving mutagenic tautomer of thymine: A QM and QTAIM insight
|
Brovarets’, Ol’ha O.
|
|
2014
|
592 |
C |
p. 247-255
9 p.
|
artikel
|
| 60 |
Study of firefly luciferin oxidation and isomerism as possible inhibition pathways for firefly bioluminescence
|
Pinto da Silva, Luís
|
|
2014
|
592 |
C |
p. 188-191
4 p.
|
artikel
|
| 61 |
Synthesis and characterization of uniform silica nanoparticles on nickel substrate by spin coating and sol–gel method
|
Ngoc Thi Le, Hien
|
|
2014
|
592 |
C |
p. 349-354
6 p.
|
artikel
|
| 62 |
The calculation of quenching rate coefficients of O2 Herzberg states in collisions with CO2, CO, N2, O2 molecules
|
Kirillov, A.S.
|
|
2014
|
592 |
C |
p. 103-108
6 p.
|
artikel
|
| 63 |
The influence of Ti- and Si-doping on the structure, morphology and photo-response properties of α-Fe2O3 for efficient water-splitting: Insights from experiment and first-principles calculations
|
Rahman, Mahfujur
|
|
2014
|
592 |
C |
p. 242-246
5 p.
|
artikel
|
| 64 |
The isotropic molecular polarizabilities of single methyl-branched alkanes in the terahertz range
|
Nickel, Daniel V.
|
|
2014
|
592 |
C |
p. 292-296
5 p.
|
artikel
|
| 65 |
Theoretical study on the photofragment branching ratios and anisotropy parameters of ICl in the second absorption band
|
Matsuoka, Takahide
|
|
2014
|
592 |
C |
p. 75-79
5 p.
|
artikel
|
| 66 |
UV–Vis spectral investigation of photophysical properties of a solvatochromic electron donor/acceptor dye within a reverse micelle domain
|
Sarkar, Amrita
|
|
2014
|
592 |
C |
p. 138-143
6 p.
|
artikel
|
| 67 |
Vibrational energies of monodeuterated dimethyl ether based on high level ab initio potential energy surfaces
|
Carvajal, M.
|
|
2014
|
592 |
C |
p. 200-205
6 p.
|
artikel
|
| 68 |
Visualisation of single atom dynamics and their role in nanocatalysts under controlled reaction environments
|
Gai, Pratibha L.
|
|
2014
|
592 |
C |
p. 355-359
5 p.
|
artikel
|
| 69 |
Wurtzite Cu2ZnSnS4 nanospindles with enhanced optical and electrical properties
|
Zhao, Yang
|
|
2014
|
592 |
C |
p. 144-148
5 p.
|
artikel
|
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