Publicaciones en las que colabora con Mauricio Rodríguez Mayorga (15)

2023

  1. Aufbau principle and singlet-triplet gap in spherical Hooke atoms

    International Journal of Quantum Chemistry, Vol. 123, Núm. 3

2022

  1. Natural range separation of the Coulomb hole

    The Journal of chemical physics, Vol. 156, Núm. 18, pp. 184106

2021

  1. Coupling Natural Orbital Functional Theory and Many-Body Perturbation Theory by Using Nondynamically Correlated Canonical Orbitals

    Journal of Chemical Theory and Computation, Vol. 17, Núm. 12, pp. 7562-7574

2019

  1. Natural orbital functional for spin-polarized periodic systems

    Journal of Physics Condensed Matter, Vol. 31, Núm. 16

  2. Partition of optical properties into orbital contributions

    Physical Chemistry Chemical Physics, Vol. 21, Núm. 28, pp. 15380-15391

  3. Singling Out Dynamic and Nondynamic Correlation

    Journal of Physical Chemistry Letters, Vol. 10, Núm. 14, pp. 4032-4037

  4. The Coulomb Hole of the Ne Atom

    ChemistryOpen, Vol. 8, Núm. 4, pp. 411-417

2018

  1. Corrigendum: On the performance of natural orbital functional approximations in the Hubbard model (Journal of Physics Condensed Matter (2017) 29 (425602) DOI: 10.1088/1361-648X/aa80ca)

    Journal of Physics Condensed Matter

  2. Electron-Pair Distribution in Chemical Bond Formation

    Journal of Physical Chemistry A, Vol. 122, Núm. 7, pp. 1916-1923

  3. Phase dilemma in natural orbital functional theory from the N-representability perspective

    European Physical Journal B, Vol. 91, Núm. 6

2017

  1. Comprehensive benchmarking of density matrix functional approximations

    Physical Chemistry Chemical Physics, Vol. 19, Núm. 35, pp. 24029-24041

  2. Electron correlation effects in third-order densities

    Physical Chemistry Chemical Physics, Vol. 19, Núm. 6, pp. 4522-4529

  3. On the performance of natural orbital functional approximations in the Hubbard model

    Journal of Physics Condensed Matter, Vol. 29, Núm. 42

2016

  1. Bonding description of the Harpoon mechanism

    Molecular Physics, Vol. 114, Núm. 7-8, pp. 1345-1355

  2. The electron-pair density distribution of the 1,3πu excited states of H2

    Canadian Journal of Chemistry, Vol. 94, Núm. 12, pp. 998-1001