Works matching IS 00207608 AND DT 2013 AND VI 113 AND IP 14

Results: 10

The 13th V. A. fock meeting on quantum and computational chemistry.

Published in:

International Journal of Quantum Chemistry, 2013, v. 113, n. 14, p. 1813, doi. 10.1002/qua.24463

By:

Tchougréeff, Andrei L.

Publication type:

Article

Inside Cover, Volume 113, Issue 14.

Published in:: International Journal of Quantum Chemistry, 2013, v. 113, n. 14, p. iii, doi. 10.1002/qua.24496
Publication type:: Article

Resonance theory of catalytic action of transition-metal complexes: Isomerization of quadricyclane to norbornadiene catalyzed by metal porphyrins.

Published in:

International Journal of Quantum Chemistry, 2013, v. 113, n. 14, p. 1833, doi. 10.1002/qua.24386

By:

Tchougréeff, Andrei L.;
Tokmachev, Andrei M.;
Dronskowski, Richard

Publication type:

Article

Cover Image, Volume 113, Issue 14.

Published in:: International Journal of Quantum Chemistry, 2013, v. 113, n. 14, p. i, doi. 10.1002/qua.24495
Publication type:: Article

Can coupled-cluster methods be used to describe excited states of the building blocks of DNA?

Published in:

International Journal of Quantum Chemistry, 2013, v. 113, n. 14, p. 1821, doi. 10.1002/qua.24392

By:

Szalay, Péter G.

Publication type:

Article

Quantum chemistry in studies of fluorescent and photosensing proteins.

Published in:

International Journal of Quantum Chemistry, 2013, v. 113, n. 14, p. 1828, doi. 10.1002/qua.24419

By:

Nemukhin, Alexander;
Topol, Igor;
Collins, Jack;
Khrenova, Maria

Publication type:

Article

Localized directed orbitals representing chemical bonds in ion-covalent crystals.

Published in:

International Journal of Quantum Chemistry, 2013, v. 113, n. 14, p. 1868, doi. 10.1002/qua.24367

By:

Abarenkov, Igor V.;
Boyko, Maksim A.;
Sushko, Peter V.

Publication type:

Article

Crystal band structure from the embedded cluster.

Published in:

International Journal of Quantum Chemistry, 2013, v. 113, n. 14, p. 1877, doi. 10.1002/qua.24410

By:

Boyko, Maksim A.;
Abarenkov, Igor V.

Publication type:

Article

Analyzing the electronic structure of molecules using continuous symmetry measures.

Published in:

International Journal of Quantum Chemistry, 2013, v. 113, n. 14, p. 1814, doi. 10.1002/qua.24373

By:

Alemany, Pere

Publication type:

Article

Dioxygen spectra and bioactivation.

Published in:

International Journal of Quantum Chemistry, 2013, v. 113, n. 14, p. 1847, doi. 10.1002/qua.24390

By:

Minaev, Boris F.;
Murugan, N. Arul;
Ågren, Hans

Publication type:

Article