Publications

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Journal Articles

5.

Zhikol, Oleg; Shishkin, Oleg

Estimating stacking interaction energy using atom in molecules properties: Homodimers of benzene and pyridine (Journal Article)

International Journal of Quantum Chemistry, 112 (18), pp. 3008-3017, 2012.

(Abstract | Links | BibTeX | Tags: Atom-atom interaction, Hydrogen bonds, Quantum chemistry)

4.

Luzanov,

Spin-free quantum chemistry: What one can gain from fock's cyclic symmetry (Journal Article)

International Journal of Quantum Chemistry, 111 (15), pp. 4042-4066, 2011.

(Abstract | Links | BibTeX | Tags: Quantum chemistry, Spin-flip model, Wave functions)

3.

Luzanov, Anatoliy

Quantum fidelity for analyzing atoms and fragments in molecule: Application to similarity, chirality, and aromaticity (Journal Article)

International Journal of Quantum Chemistry, 111 (10), pp. 2196-2220, 2011.

(Abstract | Links | BibTeX | Tags: Quantum chemistry, stereochemistry)

2.

Luzanov, Anatoliy

Matrix-covariant representation of high-order configuration interaction and coupled cluster theories (Journal Article)

International Journal of Quantum Chemistry, 108 (4), pp. 671-695, 2007.

(Abstract | Links | BibTeX | Tags: Approximation theory, Hole-particle Hamiltonians, Polyexciton models, Quantum chemistry, reduced density matrices)

1.

Luzanov,; Prezhdo,

High-order entropy measures and spin-free quantum entanglement for molecular problems (Journal Article)

Molecular Physics, 105 (19-22), pp. 2879-2891, 2007.

(Abstract | Links | BibTeX | Tags: Dissociated states, Dissociation, Electronic structure, Entropy, Entropy measure, Fock construction, Quantum chemistry, Quantum entanglement, spin-free quantum chemistry)