List of participants.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 520, doi. 10.1002/qua.10741
- Publication type:
- Article
Works matching IS 00207608 AND DT 2004 AND VI 96 AND IP 6
Results: 13
1
2
Reactivity and aromaticity of polyaromatics in radical cyclization reactions.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 568, doi. 10.1002/qua.10758
- By:
- Publication type:
- Article
3
Wave packet calculations for the Cl + H<sub>2</sub> reaction.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 562, doi. 10.1002/qua.10757
- By:
- Publication type:
- Article
4
Theoretical study of the structures and stabilities of AlC<sub>n</sub>, AlC<sup>+</sup><sub>n</sub>, and AlC<sup>-</sup><sub>n</sub> (n = 17) monocyclic clusters.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 615, doi. 10.1002/qua.10756
- By:
- Publication type:
- Article
5
Molecular electronic structure problem solved by numerical one-electron Green's functions.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 554, doi. 10.1002/qua.10749
- By:
- Publication type:
- Article
6
Quantum vs. semiclassic initial value representation probabilities for nonreactive systems.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 547, doi. 10.1002/qua.10748
- By:
- Publication type:
- Article
7
Extrapolation methods and scaled perturbation theory for determining intermolecular potential energy surfaces.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 537, doi. 10.1002/qua.10747
- By:
- Publication type:
- Article
8
Possibility of a pressure-induced 2N<sub>2</sub> → N<sub>4</sub> reaction.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 598, doi. 10.1002/qua.10746
- By:
- Publication type:
- Article
9
Ab initio description of the structure and dynamics of the nitrosomethane molecule in the first excited singlet and triplet electronic states.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 589, doi. 10.1002/qua.10745
- By:
- Publication type:
- Article
10
Generalization of the KohnSham equations with constrained electron density formalism and its time-dependent response theory formulation.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 577, doi. 10.1002/qua.10744
- By:
- Publication type:
- Article
11
Semiempirical QM/MM method for studying HCl adsorption on ice.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 607, doi. 10.1002/qua.10743
- By:
- Publication type:
- Article
12
Parallel programming library for molecular dynamics simulations.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 530, doi. 10.1002/qua.10742
- By:
- Publication type:
- Article
13
Introduction.
- Published in:
- International Journal of Quantum Chemistry, 2004, v. 96, n. 6, p. 519, doi. 10.1002/qua.10740
- By:
- Publication type:
- Article