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Oliva Enrich, José María Autor

Electronic structure and assignment of experimental 11B nuclei NMR signals in the ortho-carborane 1,2-(SH)2-1,2-C2B10H10 by ab initio calculations

  • Oliva J.M.
  • Viñas C.

Journal of Molecular Structure - 12/12/2000

10.1016/s0022-2860(00)00646-3

Número de citas: 28 (Web of Science) 27 (Scopus)
  • CiteScore: 4,6 (2020)
  • SJR: 0,574 (2000)
  • SNIP: 0,751 (2000)

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

Número de citas: 9 (Scopus)
  • Factor Impacto JCR: 3,806 (2012)
  • CiteScore: 6,7 (2020)
  • SJR: 1,364 (2012)
  • SNIP: 0,858 (2012)
  • Impacto JCR a 5 años: 3,889
  • Categorías JCR: CHEMISTRY, INORGANIC & NUCLEAR

Electronic structure of monoclinic TeMo<sub>5</sub>O<sub>16</sub>: Prediction of semiconducting behavior

  • Oliva J.M.
  • Ordejón P.
  • Canadell E.

Physical Review B - Condensed Matter and Materials Physics - 15/12/2000

10.1103/physrevb.62.16430

Número de citas: 4 (Scopus)
  • SJR: 0,11 (2000)

Electronic structure of the superconducting layered ternary nitrides and

  • Oliva J.
  • Weht R.
  • Ordejón P.
  • Canadell E.

Physical Review B - Condensed Matter and Materials Physics - 1/1/2000

10.1103/physrevb.62.1512

Número de citas: 11 (Web of Science) 10 (Scopus)
  • CiteScore: 8,6 (2016)
  • SJR: 2,786 (2000)

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

Número de citas: 11 (Scopus)
  • Factor Impacto JCR: 2,143 (2013)
  • CiteScore: 2,6 (2020)
  • SJR: 0,792 (2013)
  • SNIP: 0,755 (2013)
  • Impacto JCR a 5 años: 3,078
  • Categorías JCR: CHEMISTRY, PHYSICAL

Energy landscapes in diexo and exo/endo isomers derived from Li <sub>2</sub>B<sub>12</sub>H<sub>12</sub>

  • Oliva J.
  • Fernández-Barbero A.
  • Serrano-Andrés L.
  • Canle-L. M.
  • Santaballa J.
  • Fernández M.

Chemical Physics Letters - 20/9/2010

10.1016/j.cplett.2010.08.018

Número de citas: 6 (Scopus)
  • Cuartil SJR: Q1
  • Factor Impacto JCR: 2,282 (2010)
  • CiteScore: 3,7 (2020)
  • SJR: 1,213 (2010)
  • SNIP: 0,932 (2010)
  • Impacto JCR a 5 años: 2,23
  • Categorías JCR: CHEMISTRY, PHYSICAL
  • Categorías SJR: Physical and Theoretical Chemistry (Q1); Physics and Astronomy (miscellaneous) (Q1)

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

Número de citas: 1 (Scopus)
  • Factor Impacto JCR: 1,226 (2012)
  • CiteScore: 3,4 (2020)
  • SJR: 0,53 (2012)
  • SNIP: 0,952 (2012)
  • Impacto JCR a 5 años: 1,166
  • Categorías JCR: CHEMISTRY, MULTIDISCIPLINARY

Erratum: Solid phosphorus carbide (Chemical Communications (2002) (2494))

  • Claeyssens F.
  • Allan N.L.
  • May P.W.
  • Ordejón P.
  • Oliva J.M.

Chemical Communications - 21/8/2003

Número de citas:
  • CiteScore: 9,4 (2020)
  • SJR: 1,828 (2003)
  • SNIP: 1,239 (2003)

Erratum to: Toward (car)borane-based molecular magnets (Theor Chem Acc, 134, 9, (2015), 10.1007/s00214-014-1611-5)

  • Oliva J.
  • Alcoba D.
  • Oña O.
  • Torre A.
  • Lain L.
  • Michl J.

Theoretical Chemistry Accounts - 1/4/2016

10.1007/s00214-016-1841-9

Número de citas:
  • Factor Impacto JCR: 1,89 (2016)
  • CiteScore: 2,6 (2020)
  • SJR: 0,527 (2016)
  • SNIP: 0,588 (2016)
  • Impacto JCR a 5 años: 1,839
  • Categorías JCR: CHEMISTRY, PHYSICAL
Open Access

Experimental and Computational Studies on the Gas-Phase Acidity of 5,5-Dialkyl Barbituric Acids

  • Dávalos-Prado J.Z.
  • González J.
  • Oliva-Enrich J.M.
  • Urrunaga E.J.
  • Lago A.F.

Journal of the American Society for Mass Spectrometry - 1/1/2021

10.1021/jasms.1c00123

Número de citas:
  • Factor Impacto JCR: 3,262 (2021)
  • CiteScore: 5,4 (2020)
  • SJR: 0,961 (2020)
  • SNIP: 0,779 (2020)
  • Impacto JCR a 5 años: 3,472
  • Categorías JCR: CHEMISTRY, PHYSICAL

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

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

Número de citas: 9 (Scopus)
  • Factor Impacto JCR: 2,161 (2012)
  • CiteScore: 2 (2020)
  • SJR: 0,704 (2012)
  • SNIP: 1,7 (2012)
  • Impacto JCR a 5 años: 1,694
  • Categorías JCR: CHEMISTRY, PHYSICAL

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

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

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
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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

Número de citas: 6 (Scopus)
  • CiteScore: 1,7 (2020)

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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

Número de citas: 1 (Web of Science)

Scopus: 20

Web of Science: 17

Scopus: 37

Web of Science: 27

Última actualización de los datos: 4/05/24 5:24
Próxima recolección programada: 11/05/24 3:00