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Theoretica Chimica Acta
Published by Springer-Verlag.
ISSN 0040-5744
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Aims & scope
Theoretica Chimica Acta publishes peer-reviewed research. Manuscripts pass a technical check and a scope check by the handling editor before going to independent reviewers.
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Recently published
Symmetry adaptation and the utilization of point group symmetry in valence bond calculations, including CASVB
DOI 10.1007/bf02341697 Thorstein Thorsteinsson, David L. Cooper, Joseph Gerratt, Mario Raimondi · 1997
A method for population and bonding analyses in calculations with extended basis sets
DOI 10.1007/bf02341693 Wenjian Liu, Lemin Li · 1997
A simple correction to final state energies of doublet radicals described by equation-of-motion coupled cluster theory in the singles and doubles approximation (Erratum)
DOI 10.1007/bf02341694 John F. Stanton, Jürgen Gauss · 1997
Molecular structures of mononitroanilines and their thermal decomposition products
DOI 10.1007/bf02341695 P. C. Chen, W. Lo, K. H. Hu · 1997
Analytical Hartree-Fock electron densities for atoms He through Lr
DOI 10.1007/bf02341696 Toshikatsu Koga · 1997
On chiral pathways inE n : A dimensional analysis
DOI 10.1007/bf02341691 Noham Weinberg, Kurt Mislow · 1997
The delocalisation energy of benzene and the non-empirical MO theory
DOI 10.1007/bf02341692 Melvyn P. Melrose · 1997
Size-consistent single-reference methods for electronic correlation: a unified formulation through intermediate hamiltonian theory
DOI 10.1007/s002140050193 José Sánchez-Marín, Ignacio Nebot-Gil, Jean Paul Malrieu, Jean Louis Heully, Daniel Maynau · 1997
The delocalisation energy of benzene and the non-empirical MO theory
DOI 10.1007/s002140050184 Melvyn P. Melrose · 1997
Diatomic interaction energies in the topological theory of atoms in molecules
DOI 10.1007/bf02329238 Anibal Sierraalta, Gernot Frenking · 1997
Møller-Plesset correlation energies in a localized orbital basis using a Laplace transform technique
DOI 10.1007/bf02329241 Angela K. Wilson, Jan Almlöf · 1997
Spin–orbit corrections to the indirect nuclear spin–spin coupling constants in XH
DOI 10.1007/s002140050181 Sheela Kirpekar, Hans Jørgen Aagaard Jensen, Jens Oddershede · 1997
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