| nr |
titel |
auteur |
tijdschrift |
jaar |
jaarg. |
afl. |
pagina('s) |
type |
| 1 |
A density functional theory study of the anthracene anion
|
Dessent, Caroline E.H.
|
|
2000
|
330 |
1-2 |
p. 180-187
8 p.
|
artikel
|
| 2 |
A feasible transcorrelated method for treating electronic cusps using a frozen Gaussian geminal
|
Ten-no, Seiichiro
|
|
2000
|
330 |
1-2 |
p. 169-174
6 p.
|
artikel
|
| 3 |
An ab initio study of the low-lying electronic excited states of CH3OBr
|
Guha, Sujata
|
|
2000
|
330 |
1-2 |
p. 195-198
4 p.
|
artikel
|
| 4 |
Apparent tunneling in chemical reactions
|
Henriksen, Niels E.
|
|
2000
|
330 |
1-2 |
p. 139-145
7 p.
|
artikel
|
| 5 |
A TDDFT study of the electronic spectrum of s-tetrazine in the gas-phase and in aqueous solution
|
Adamo, Carlo
|
|
2000
|
330 |
1-2 |
p. 152-160
9 p.
|
artikel
|
| 6 |
Basic ideas for the correction of semiempirical methods describing H-bonded systems
|
Bernal-Uruchurtu, M.I.
|
|
2000
|
330 |
1-2 |
p. 118-124
7 p.
|
artikel
|
| 7 |
Calculation of the linear response function by the atom–bond electronegativity equalization method (ABEEM)
|
Wang, Chang-Sheng
|
|
2000
|
330 |
1-2 |
p. 132-138
7 p.
|
artikel
|
| 8 |
Catalytic growth of carbon nanoballs with and without cobalt encapsulation
|
Zhong, Ziyi
|
|
2000
|
330 |
1-2 |
p. 41-47
7 p.
|
artikel
|
| 9 |
Controlling the folding/unfolding transition of the DNA–histone H1 complex by direct optical manipulation
|
Yoshikawa, Yuko
|
|
2000
|
330 |
1-2 |
p. 77-82
6 p.
|
artikel
|
| 10 |
Deposition of carbon nanotubes on Si nanowires by chemical vapor deposition
|
Zhang, Y.F
|
|
2000
|
330 |
1-2 |
p. 48-52
5 p.
|
artikel
|
| 11 |
Distribution of effectively unpaired electrons
|
Staroverov, Viktor N.
|
|
2000
|
330 |
1-2 |
p. 161-168
8 p.
|
artikel
|
| 12 |
Electron and positron scattering from CF3I molecules below 600 eV: a comparison with CF3H
|
Kawada, Michihito K
|
|
2000
|
330 |
1-2 |
p. 34-40
7 p.
|
artikel
|
| 13 |
Fourier transform infrared spectroscopic study of Br2O and OBrO
|
Chu, Liang T
|
|
2000
|
330 |
1-2 |
p. 68-76
9 p.
|
artikel
|
| 14 |
Full-CI calculation of imaginary frequency-dependent dipole polarizabilities of ground state LiH and the C6 dispersion coefficients of LiH–LiH
|
Bendazzoli, Gian Luigi
|
|
2000
|
330 |
1-2 |
p. 146-151
6 p.
|
artikel
|
| 15 |
Kinetics of alkali insertion in single wall carbon nanotubes: an electrochemical impedance spectroscopy study
|
Claye, Agnès
|
|
2000
|
330 |
1-2 |
p. 61-67
7 p.
|
artikel
|
| 16 |
Local-mode oscillations at a liquid interface
|
Phillips, Leon F
|
|
2000
|
330 |
1-2 |
p. 15-20
6 p.
|
artikel
|
| 17 |
Novel decay channels of carbon cluster ions, C40 z+ and C41 z+ (z=3,4)
|
Parajuli, R
|
|
2000
|
330 |
1-2 |
p. 53-60
8 p.
|
artikel
|
| 18 |
Nuclear motion in the O 1s−12πu core-excited states of CO2 probed by sub-natural-width resonant Auger emission spectroscopy
|
Muramatsu, Y
|
|
2000
|
330 |
1-2 |
p. 91-96
6 p.
|
artikel
|
| 19 |
Observation of intramolecular dimer radical anion of 1,1-diarylmethanols bearing electron withdrawing groups at room temperature
|
Ichinose, Nobuyuki
|
|
2000
|
330 |
1-2 |
p. 97-102
6 p.
|
artikel
|
| 20 |
On the photoelectron spectrum of Ga2P2 −
|
Archibong, Edet F
|
|
2000
|
330 |
1-2 |
p. 199-206
8 p.
|
artikel
|
| 21 |
Quantum dynamics of SN2 reactions on CCSD(T) potential energy surfaces: Cl−+CH3Cl and Cl−+CH3Br
|
Schmatz, Stefan
|
|
2000
|
330 |
1-2 |
p. 188-194
7 p.
|
artikel
|
| 22 |
Rate coefficients for the reaction N2(i)+N=3N: a comparison of trajectory calculations and the Treanor–Marrone model
|
Capitelli, M.
|
|
2000
|
330 |
1-2 |
p. 207-211
5 p.
|
artikel
|
| 23 |
Relaxation of average energy and rearrangement of solvent shells in various polar solvents in connection with solvation dynamics: studied by RISM theory
|
Nishiyama, Katsura
|
|
2000
|
330 |
1-2 |
p. 125-131
7 p.
|
artikel
|
| 24 |
STM studies of passivated Au nanocrystals immobilised on a passivated Au(111) surface: ordered arrays and single electron tunnelling
|
Osman, H
|
|
2000
|
330 |
1-2 |
p. 1-6
6 p.
|
artikel
|
| 25 |
Studies on tautomerism in tetrazole: comparison of Hartree–Fock and density functional theory quantum chemical methods
|
Mazurek, A.P
|
|
2000
|
330 |
1-2 |
p. 212-218
7 p.
|
artikel
|
| 26 |
Substrate-induced demixing in a confined liquid crystal film
|
Latham, Richard
|
|
2000
|
330 |
1-2 |
p. 7-14
8 p.
|
artikel
|
| 27 |
Surfactant-induced modification of quenching of conjugated polymer fluorescence by electron acceptors: applications for chemical sensing
|
Chen, Liaohai
|
|
2000
|
330 |
1-2 |
p. 27-33
7 p.
|
artikel
|
| 28 |
The dissociation energy of van der Waals complexes determined by velocity map imaging: values for S0 and S1 p-difluorobenzene–Ar and D0 (p-difluorobenzene–Ar)+
|
Bellm, Susan M
|
|
2000
|
330 |
1-2 |
p. 103-109
7 p.
|
artikel
|
| 29 |
Three-electron integral evaluation in the transcorrelated method using a frozen Gaussian geminal
|
Ten-no, Seiichiro
|
|
2000
|
330 |
1-2 |
p. 175-179
5 p.
|
artikel
|
| 30 |
Ultrafast excited-state proton transfer dynamics of 1,8-dihydroxyanthraquinone (chrysazin) studied by femtosecond time-resolved fluorescence spectroscopy
|
Arzhantsev, Sergei Yu
|
|
2000
|
330 |
1-2 |
p. 83-90
8 p.
|
artikel
|
| 31 |
Volumetric and infrared co-measurements of CH4 and CO isotherms on microporous ice
|
Manca, C
|
|
2000
|
330 |
1-2 |
p. 21-26
6 p.
|
artikel
|
| 32 |
Zero-field muon spin rotation study on genuine organic ferromagnets, 4-arylmethyleneamino-2,2,6,6-tetramethylpiperidin-1-yloxyls (aryl=4-biphenylyl and phenyl)
|
Ishida, Takayuki
|
|
2000
|
330 |
1-2 |
p. 110-117
8 p.
|
artikel
|
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