| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
Ab initio ground and the first excited adiabatic and quasidiabatic potential energy surfaces of H+ +CO system
|
George D.X., F.
|
|
2010
|
373 |
3 |
p. 211-218
8 p.
|
artikel
|
| 2 |
Analytical solution of the master equation with the transition probability derived from dynamical considerations
|
Strekalov, M.L.
|
|
2010
|
373 |
3 |
p. 289-294
6 p.
|
artikel
|
| 3 |
(B + E ⊗ b)⊗ e Jahn–Teller and pseudo-Jahn–Teller effects in the spiropentane radical cation
|
Kumar, R.R.
|
|
2010
|
373 |
3 |
p. 228-237
10 p.
|
artikel
|
| 4 |
Contents
|
|
|
2010
|
373 |
3 |
p. iii-viii
nvt p.
|
artikel
|
| 5 |
Density-functional study for the NO x (x =1, 2) dissociation mechanism on the Cu(111) surface
|
Yen, Mei-Yin
|
|
2010
|
373 |
3 |
p. 300-306
7 p.
|
artikel
|
| 6 |
Donor–acceptor nonradiative energy transfer mediated by surface plasmons on ultrathin metallic films
|
Jankowski, Dawid
|
|
2010
|
373 |
3 |
p. 238-242
5 p.
|
artikel
|
| 7 |
Empirical line parameters of methane in the 1.63–1.48μm transparency window by high sensitivity Cavity Ring Down Spectroscopy
|
Campargue, A.
|
|
2010
|
373 |
3 |
p. 203-210
8 p.
|
artikel
|
| 8 |
IFC (Editorial Board)
|
|
|
2010
|
373 |
3 |
p. IFC-
1 p.
|
artikel
|
| 9 |
Measuring molecular force fields: Terahertz, inelastic neutron scattering, Raman, FTIR, DFT, and BOMD molecular dynamics of solid l-serine
|
Williams, Robert W.
|
|
2010
|
373 |
3 |
p. 251-260
10 p.
|
artikel
|
| 10 |
Modelling of interactions between volatile anaesthetics (halothane, enflurane) and aromatic compounds, ab initio study
|
Zierkiewicz, Wiktor
|
|
2010
|
373 |
3 |
p. 243-250
8 p.
|
artikel
|
| 11 |
Molecular designing of novel ternary copolymers of donor–acceptor polymers using genetic algorithm
|
Arora, Vinita
|
|
2010
|
373 |
3 |
p. 307-312
6 p.
|
artikel
|
| 12 |
Morphological and electrical characteristics of amino acid–AuNP nanostructured two-dimensional ensembles
|
Orza, Anamaria
|
|
2010
|
373 |
3 |
p. 295-299
5 p.
|
artikel
|
| 13 |
Multiply ionization of diethyl ether clusters by 532nm nanosecond laser: The influence of laser intensity and the electron energy distribution
|
Zhang, Nazhen
|
|
2010
|
373 |
3 |
p. 181-185
5 p.
|
artikel
|
| 14 |
Nitro group photoreduction of 4-(2-nitrophenyl)- and 4-(3-nitrophenyl)-1,4-dihydropyridines
|
Görner, Helmut
|
|
2010
|
373 |
3 |
p. 153-158
6 p.
|
artikel
|
| 15 |
Restricted open-shell Kohn–Sham theory: N unpaired electrons
|
Schulte, Marius
|
|
2010
|
373 |
3 |
p. 283-288
6 p.
|
artikel
|
| 16 |
Statistical properties of the energies and electric dipole moments of the bound vibrational states of the system HCO+/COH+
|
Kraemer, Wolfgang P.
|
|
2010
|
373 |
3 |
p. 170-180
11 p.
|
artikel
|
| 17 |
Subject Index
|
|
|
2010
|
373 |
3 |
p. 313-319
7 p.
|
artikel
|
| 18 |
The electronic states of buta-1,3-diene studied by ab initio configuration interaction and DFT methods, and electron energy loss spectroscopy
|
Palmer, Michael H.
|
|
2010
|
373 |
3 |
p. 159-169
11 p.
|
artikel
|
| 19 |
Theoretical spectroscopy and metastability of BeS and its cation
|
Larbi, T.
|
|
2010
|
373 |
3 |
p. 193-202
10 p.
|
artikel
|
| 20 |
Theoretical study of X-ray photoelectron diffraction for fixed-in-space CO molecules
|
Kazama, Misato
|
|
2010
|
373 |
3 |
p. 261-266
6 p.
|
artikel
|
| 21 |
Thermodynamic and structural study of pyrene-1-carboxaldehyde/DNA interactions by molecular spectroscopy: Probing intercalation and binding properties
|
Grueso, E.
|
|
2010
|
373 |
3 |
p. 186-192
7 p.
|
artikel
|
| 22 |
Using semiclassical surface hopping for coupled partial wave calculations on systems with non-spherically symmetric potentials
|
Herman, Michael F.
|
|
2010
|
373 |
3 |
p. 274-282
9 p.
|
artikel
|
| 23 |
Vibrational spectra and structures of urazole and 4-methylurazole: DFT calculations of the normal modes in aqueous solution and in the solid state, and the influence of hydrogen bonding
|
Ryall, John P.
|
|
2010
|
373 |
3 |
p. 219-227
9 p.
|
artikel
|
| 24 |
VSCF in internal coordinates and the calculation of anharmonic torsional mode transitions
|
Suwan, Iyad
|
|
2010
|
373 |
3 |
p. 267-273
7 p.
|
artikel
|
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