Oliva Enrich, José María Author

Electronic structure studies of diradicals derived from closo-carboranes

  • Oliva J.M.
  • Alcoba D.R.
  • Lain L.
  • Torre A.

Theoretical Chemistry Accounts - 1/3/2013

10.1007/s00214-012-1329-1

Cite count: 11 (Scopus)
Open Access

Borane polyhedra as building blocks for unknown but potentially isolatable new molecules - Extensions based on computations of the known B <sub>18</sub>H<sub>22</sub> isomers

  • Oliva J.M.
  • Rué J.
  • Hnyk D.
  • Kennedy J.D.
  • Rosenfeld V.R.

Croatica Chemica Acta - 1/12/2013

10.5562/cca2304

Cite count: 7 (Scopus)

Anionic oligomerization of Li<sub>2</sub>[B<sub>12</sub>H<sub>12</sub>] and Li[CB<sub>11</sub>H<sub>12</sub>]: An experimental and computational study

  • Dávalos J.
  • González J.
  • Guerrero A.
  • Hnyk D.
  • Holub J.
  • Oliva J.

Journal of Physical Chemistry C - 24/1/2013

10.1021/jp3102354

Cite count: 9 (Scopus)

Enumeration of polycarborane isomers: Especially dicarboranes

  • Rosenfeld V.R.
  • Klein D.J.
  • Oliva J.M.

Journal of Mathematical Chemistry - 1/8/2012

10.1007/s10910-012-0017-7

Cite count: 1 (Scopus)

The H <sub>4</sub> model revisited within the framework of the G-particle-hole Hypervirial equation

  • Valdemoro C.
  • Alcoba D.
  • Oña O.
  • Tel L.
  • Pérez-Romero E.
  • Oliva J.

Chemical Physics - 3/5/2012

10.1016/j.chemphys.2011.06.025

Cite count: 5 (Scopus)

Modelling X-ray scattering factors from fluids of some fluorinated molecules and related compounds

  • Forte G.
  • Oliva J.
  • Balaban A.
  • Klein D.
  • March N.

Physics and Chemistry of Liquids - 1/5/2012

10.1080/00319104.2011.647625

Cite count:

Merging boron solid state and molecular chemistry: Energy landscapes in the exo/endo closo-borane complex Sc[B <sub>24</sub>H <sub>24</sub>] <sup>+</sup>

  • Oliva J.
  • Vegas A.

Chemical Physics Letters - 23/4/2012

10.1016/j.cplett.2012.02.072

Cite count: 7 (Scopus)

Chain carborane molecules

  • Rosenfeld V.
  • Oliva J.
  • Klein D.

Monatshefte fur Chemie - 1/3/2012

10.1007/s00706-011-0689-x

Cite count: 2 (Scopus)

Distinct photophysics of the isomers of B18H22 explained

  • Londesborough M.
  • Hnyk D.
  • Bould J.
  • Serrano-Andrés L.
  • Sauri V.
  • Oliva J.
  • Kubát P.
  • Polívka T.
  • Lang K.
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INORGANIC CHEMISTRY - 6/2/2012

10.1021/ic201726k

Cite count: 47 (Web of Science) 35 (Scopus)

Electronic structure and geometries of o-carborane derived cyclic structures [(μ-1,2-(C<sub>2</sub>B<sub>10</sub>H<sub>10</sub>)<sub>n</sub>M<sub>n</sub>)Ag<sub>m</sub>]<sup>z−</sup>, M = (Au, Hg), n = (3, 4), m = (0, 1, 2), z = (n − m, −m)

  • Aullón G.
  • Laguna A.
  • Oliva J.M.

Journal of the Chemical Society. Dalton Transactions - 6/11/2012

10.1039/c2dt31047c

Cite count: 9 (Scopus)

Progress in Electronic-Structure Based Computational Methods: From Small Molecules to Large Molecular Systems of Biological Significance

  • Laimutis Bytautas
  • Douglas J. Klein
  • Demeter Tzeli
  • Maxime Ferrer
  • José Elguero
  • Ibon Alkorta
  • Josep M. Oliva-Enrich
... View more Collapse

Frontiers in Computational Chemistry: Volume 6 - 7/09/2022

10.2174/9789815036848122060008

  • ORCID

Quantum Chemistry of Excited States in Polyhedral Boranes

  • Oliva J.
  • Francés-Monerris A.
  • Roca-Sanjuán D.

Challenges and Advances in Computational Chemistry and Physics - 1/1/2015

10.1007/978-3-319-22282-0_4

Cite count: 6 (Scopus)

Energy Landscapes in Boron Chemistry: Bottom-Top Approach Toward Design of Novel Molecular Architectures

  • Oliva J.

Advances in Quantum Chemistry - 1/1/2012

10.1016/b978-0-12-396498-4.00004-1

Cite count: 9 (Scopus)

Non-relativistic Hartree-Fock energy spectra in icosahedral symmetry molecules with electronic configuration h(2)

  • Josep M. Oliva-Enrich

Proceedings of the 5th Wigner Symposium - 07/1998

10.1142/3785

  • ORCID

Conformational analysis from the viewpoint of molecular similarity

  • Josep M. Oliva-Enrich

Advances in Molecular Similarity - 1996

10.1016/s1873-9776(96)80009-5

  • ORCID

Hartree-fock states energy spectra for icosahedral open-shell structures with electronic configurations h(N) (N=1-9)

  • Josep M. Oliva-Enrich

Universitat de Girona - 1994

  • ORCID

This author has no conferences.

This author has no patents.

A Quantum-Chemical Study of Boro-Fullerenes B<sub>60</sub>H<sub>60 </sub>, B<sub>60</sub>F<sub>30</sub>H<sub>30</sub> , and B<sub>60</sub>F<sub>60</sub>

10.20944/preprints202204.0115.v1

  • ORCID

Proton affinities of amino group functionalizing 2D and 3D boron compounds

  • Oliva-Enrich, J. M.
  • Humbel, S.
  • Davalos, J. Z.
  • Holub, J.
  • Hnyk, D.

AFINIDAD - 2018

Cite count: 1 (Web of Science)

Scopus: 20

Web of Science: 17

Scopus: 37

Web of Science: 27

Last data update: 4/27/24 5:22 AM
Next scheduled update: 5/4/24 3:00 AM