no |
title |
author |
magazine |
year |
volume |
issue |
page(s) |
type |
1 |
Ab initio and B3LYP–DFT calculations of GaP− and GaP2 −: the electron affinities and vibrational frequencies of GaP and GaP2
|
Archibong, Edet F |
|
2000 |
316 |
1-2 |
p. 151-159 9 p. |
article |
2 |
An ab initio study on the insertion reaction of silylenoid H2SiLiF with H2
|
Feng, Shengyu |
|
2000 |
316 |
1-2 |
p. 146-150 5 p. |
article |
3 |
An unusual `ring-puckering': tunneling of Ar in difluoromethane–Ar
|
López, J.Carlos |
|
2000 |
316 |
1-2 |
p. 81-87 7 p. |
article |
4 |
Assessment of exchange correlation functionals
|
Cohen, Aron J |
|
2000 |
316 |
1-2 |
p. 160-166 7 p. |
article |
5 |
Conformational, optical and photophysical properties of a substituted terfluorene isolated and incorporated in a polyester
|
Belletête, Michel |
|
2000 |
316 |
1-2 |
p. 101-107 7 p. |
article |
6 |
Controlling single-wall nanotube diameters with variation in laser pulse power
|
Dillon, A.C. |
|
2000 |
316 |
1-2 |
p. 13-18 6 p. |
article |
7 |
Dimensionality and temperature dependence of the radiative lifetime of J-aggregates with Davydov splitting of the exciton band
|
Scheblykin, I.G. |
|
2000 |
316 |
1-2 |
p. 37-44 8 p. |
article |
8 |
Dynamics in globular proteins: vibrational echo experiments
|
Rector, K.D |
|
2000 |
316 |
1-2 |
p. 122-128 7 p. |
article |
9 |
Energetics of monohydrated chiral R(+)-1-phenyl-1-propanol: supersonic beam experiments and density functional calculations
|
Satta, M. |
|
2000 |
316 |
1-2 |
p. 94-100 7 p. |
article |
10 |
Excited-state proton transfer of 7-hydroxyquinoline in a non-polar medium: mechanism of triple proton transfer in the hydrogen-bonded system
|
Kohtani, Shigeru |
|
2000 |
316 |
1-2 |
p. 88-93 6 p. |
article |
11 |
Extension of the PCNQM model for the calculation of electric field gradient tensors in asymmetric molecules. The carbon electric field gradient in CH3CHFCl
|
Pernpointner, Markus |
|
2000 |
316 |
1-2 |
p. 141-145 5 p. |
article |
12 |
Femtosecond dynamics of electronic `bubbles' in solid argon: viewing the inertial response and the bath coherences
|
Jeannin, Catherine |
|
2000 |
316 |
1-2 |
p. 51-59 9 p. |
article |
13 |
Fluorescence excitation and fluorescence spectra of jet-cooled acridine molecules: acridine dimer formation and structure
|
Prochorow, J. |
|
2000 |
316 |
1-2 |
p. 24-30 7 p. |
article |
14 |
Fluorescence photon bursts from low surface-density dioctadecyl-rhodamine B molecules at the air–water surface observed with a confocal fluorescence photon-counting microscope
|
Zheng, Xue-Ying |
|
2000 |
316 |
1-2 |
p. 6-12 7 p. |
article |
15 |
Fragmentation of Na3 + clusters by He impact: effect of initial cluster temperature on non-adiabatic phenomena
|
Babikov, D |
|
2000 |
316 |
1-2 |
p. 129-134 6 p. |
article |
16 |
Geometries and vibrational frequencies for calcium and strontium radical salts of C5H5, C5H4CH3, C4H4N, and BH4
|
Chan, Wai-To |
|
2000 |
316 |
1-2 |
p. 171-175 5 p. |
article |
17 |
Infrared matrix isolation studies of nitrous acid complexes with methane, silane and germane
|
Mielke, Zofia |
|
2000 |
316 |
1-2 |
p. 108-114 7 p. |
article |
18 |
Locked alkenes with a short triplet state lifetime
|
Filatov, M |
|
2000 |
316 |
1-2 |
p. 135-140 6 p. |
article |
19 |
MH2+⋅ ion production from protonated polypeptides by electron impact: observation and determination of ionization energies and a cross-section
|
Budnik, Bogdan A. |
|
2000 |
316 |
1-2 |
p. 19-23 5 p. |
article |
20 |
On the important role played by polarization functions in calculations involving hypervalent molecules
|
Sordo, J.A. |
|
2000 |
316 |
1-2 |
p. 167-170 4 p. |
article |
21 |
Photoionization of HOCO revisited: a new upper limit to the adiabatic ionization energy and lower limit to the enthalpy of formation
|
Ruscic, Branko |
|
2000 |
316 |
1-2 |
p. 45-50 6 p. |
article |
22 |
Photophysical characteristics of diphenyl carbazide-laser flash photolysis and fluorescence studies
|
Bhasikuttan, A.C. |
|
2000 |
316 |
1-2 |
p. 67-74 8 p. |
article |
23 |
Rotational spectrum of 1,1-difluoroethane–argon: influence of the interaction with the Ar atom on the V3 barrier to internal rotation of the methyl group
|
Velino, Biagio |
|
2000 |
316 |
1-2 |
p. 75-80 6 p. |
article |
24 |
Surface-enhanced Raman scattering from bare Fe electrode surfaces
|
Cao, P.G. |
|
2000 |
316 |
1-2 |
p. 1-5 5 p. |
article |
25 |
The ground and charge-transfer excited states of CoO+
|
Kamariotis, A |
|
2000 |
316 |
1-2 |
p. 60-66 7 p. |
article |
26 |
The interplay between the electronic structure and reactivity of aluminum clusters: model systems as building blocks for cluster assembled materials
|
Leskiw, B.D. |
|
2000 |
316 |
1-2 |
p. 31-36 6 p. |
article |
27 |
UV photolysis in rare-gas solids: spectral overlap between absorbers and emitters
|
Khriachtchev, Leonid |
|
2000 |
316 |
1-2 |
p. 115-121 7 p. |
article |