Oliva Enrich, José María Autor

Solution and Computed Structure of o-Lithium N,N-Diisopropyl-P,P-diphenylphosphinic Amide. Unprecedented Li-O-Li-O Self-Assembly of an Aryllithium

  • Fernandez, Ignacio
  • Ona-Burgos, Pascual
  • Oliva, Josep M.
  • Lopez-Ortiz, Fernando

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY - 14/4/2010

10.1021/ja910556a

Número de citas: 22 (Web of Science) 20 (Scopus)

Solid phosphorus carbide?

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

Chemical Communications - 1/1/2002

10.1039/b207743b

Número de citas: 18 (Scopus)

Solid phases of phosphorus carbide: An ab initio study

  • Claeyssens F.
  • Hart J.
  • Allan N.
  • Oliva J.

Physical Review B - Condensed Matter and Materials Physics - 23/04/2009

10.1103/physrevb.79.134115

Número de citas: 31 (Scopus)

Sequestration of Carbon Dioxide with Frustrated Lewis Pairs Based on N-Heterocycles with Silane/Germane Groups

  • Ferrer M.
  • Alkorta I.
  • Elguero J.
  • Oliva-Enrich J.M.

JOURNAL OF PHYSICAL CHEMISTRY A - 19/8/2021

10.1021/acs.jpca.1c04787

Número de citas: 12 (Web of Science)

Self-consistent field (SCF) theory of highly symmetric open-shell molecules: Difficulties arisen in the monoconfigurational approximation

  • Oliva J.

Afinidad - 1/3/1997

Número de citas:

Reactivity of a model of B3P3-doped nanographene with up to three CO2 molecules

  • Ferrer M.
  • Alkorta I.
  • Elguero J.
  • Oliva-Enrich J.M.

Scientific Reports - 1/12/2023

10.1038/s41598-023-29336-y

Número de citas: 4 (Web of Science) 1 (Scopus)

Rate constant calculations in the dimerization of diaminocarbene: A direct dynamics study

  • Oliva J.

Chemical Physics Letters - 12/03/1999

10.1016/s0009-2614(99)00110-4

Número de citas: 8 (Scopus)

Quantitative vs. qualitative approaches to the electronic structure of solids

  • Oliva J.M.
  • Llunell M.
  • Alemany P.
  • Canadell E.

Journal of Solid State Chemistry - 1/12/2003

10.1016/s0022-4596(03)00219-6

Número de citas: 7 (Scopus)
Open Access

(Pyridin-2-ylmethyl)triel Derivatives as Masked Frustrated Lewis Pairs. Interactions and CO<inf>2</inf>-Sequestration

  • Ferrer M.
  • Alkorta I.
  • Elguero J.
  • Oliva-Enrich J.M.

ChemPhysChem - 15/3/2024

10.1002/cphc.202300750

Número de citas:

Proton affinities of amino group functionalizing 2D and 3D boron compounds,Afinitats protòniques del grup amino en compostos 2D i 3D de bor,Afinidades protónicas del grupo amino en compuestos 2D y 3D de boro

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

Afinidad - 2018

  • 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)

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
... Ver más Contraer

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

10.2174/9789815036848122060008

  • 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

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

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)

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

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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)

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

Scopus: 20

Web of Science: 17

Scopus: 37

Web of Science: 27

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Próxima recolección programada: 11/05/24 3:00