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                             8 results found
no title author magazine year volume issue page(s) type
1 Ab initio calculations for the potential curves and spin–orbit coupling of Mg2 Czuchaj, E.
 2001
 107 1 p. 27-32
 article
2 A theoretical study on the ionization of OCS with an analysis of vibrational structures of the photoelectron spectrum Takeshita, Kouichi
 2001
 107 1 p. 33-37
 article
3 Dual-level direct dynamics calculations of deuterium kinetic isotope effects for the Cl(2P)+C2H6 abstraction reaction Roberto-Neto, O.
 2000
 107 1 p. 15-21
 article
4 Fully relativistic correlated benchmark results for uranyl and a critical look at relativistic effective core potentials for uranium de Jong, W. A.
 2001
 107 1 p. 22-26
 article
5 Molecular dynamics, density functional and second-order Møller–Plesset theory study of the structure and conformation of acetylcholine in vacuo and in solution Marino, T.
 2001
 107 1 p. 8-14
 article
6 Reparameterization of hybrid functionals based on energy differences of states of different multiplicity Reiher, Markus
 2001
 107 1 p. 48-55
 article
7 Second-order energy components in basis-set-superposition-error-free intermolecular perturbation theory Hamza, A.
 2001
 107 1 p. 38-47
 article
8 Theoretical study of the potential-energy surface of C2NP Ding, Yi-hong
 2001
 107 1 p. 1-7
 article
                             8 results found
 
 Koninklijke Bibliotheek - National Library of the Netherlands