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Koch D, Pavanello M, Shao X, et al. (2024) The Analysis of Electron Densities: From Basics to Emergent Applications. Chemical Reviews |
Jara-Cortés J, Matta CF, Hernández-Trujillo J. (2022) A fast approximate extension of the interacting quantum atoms energy decomposition to excited states. Journal of Computational Chemistry. 43: 1068-1078 |
Sowlati-Hashjin S, Karttunen M, Matta CF. (2020) Manipulation of Diatomic Molecules with Oriented External Electric Fields: Linear Correlations in Atomic Properties Lead to Non-Linear Molecular Responses. The Journal of Physical Chemistry. A |
Matta CF, Lombardi O, Jaimes Arriaga J. (2020) Two-step emergence: the quantum theory of atoms in molecules as a bridge between quantum mechanics and molecular chemistry Foundations of Chemistry. 22: 107-129 |
Massa L, Keith T, Cheng Y, et al. (2019) The kernel energy method applied to quantum theory of atoms in molecules – energies of interacting quantum atoms Chemical Physics Letters. 734: 136650 |
Braden DA, Matta CF. (2018) On the Unusual Synclinal Conformations of Hexafluorobutadiene and Structurally Similar Molecules. The Journal of Physical Chemistry. A. 122: 4538-4548 |
Gatti C, Macetti G, Boyd RJ, et al. (2018) An electron density source-function study of DNA base pairs in their neutral and ionized ground states. Journal of Computational Chemistry |
Matta CF. (2017) On the connections between the quantum theory of atoms in molecules (QTAIM) and density functional theory (DFT): a letter from Richard F. W. Bader to Lou Massa Structural Chemistry. 28: 1591-1597 |
Arabi AA, Matta CF. (2016) Electrostatic potentials and average electron densities of bioisosteres in methylsquarate and acetic acid. Future Medicinal Chemistry. 8: 361-71 |
Terrabuio LA, Teodoro TQ, Matta CF, et al. (2016) Nonnuclear Attractors in Heteronuclear Diatomic Systems. The Journal of Physical Chemistry. A. 120: 1168-74 |