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Guevara Vela, Jose Manuel jose.guevara@uam.es

Química física aplicada / Universidad Autónoma de Madrid

Publications

A QCT View of the Interplay between Hydrogen Bonds and Aromaticity in Small CHON Derivatives

  • Gallegos M
  • Barrena-Espés D
  • Guevara-Vela JM
  • Rocha-Rinza T
  • Pendás ÁM

MOLECULES - 1/9/2022

10.3390/molecules27186039 View at source

  • ISSN 14203049

Accurate prediction of the solid-state region of the Ni-Al phase diagram including configurational and vibrational entropy and magnetic effects

  • Shao, W
  • Guevara-Vela, JM
  • Fernández-Caballero, A
  • Liu, S
  • LLorca, J

Acta Materialia - 1/7/2023

10.1016/j.actamat.2023.118962 View at source

  • ISSN 13596454

An unexpected bridge between chemical bonding indicators and electrical conductivity through the localization tensor

  • Pendas, AM
  • Guevara-Vela, JM
  • Crespo, DM
  • Costales, A
  • Francisco, E

Physical Chemistry Chemical Physics (p. 1790-1797) - 1/1/2017

10.1039/c6cp07617c View at source

  • ISSN 14639076

Atoms in molecules in real space: a fertile field for chemical bonding

  • Martín Pendás Á
  • Francisco E
  • Suárez D
  • Costales A
  • Díaz N
  • Munárriz J
  • Rocha-Rinza T
  • Guevara-Vela JM
... View more Collapse

Physical Chemistry Chemical Physics (p. 10231-10262) - 15/3/2023

10.1039/d2cp05540f

  • ISSN 14639076
  • iMarina

Binding Energy Partition of Promising IRAK-4 Inhibitor (Zimlovisertib) for the Treatment of COVID-19 Pneumonia

  • Zapata-Acevedo CA, Guevara-Vela JM, Popelier PLA, Rocha-Rinza T

Chemphyschem - 16/12/2022

10.1002/cphc.202200855 View at source

  • ISSN 14394235

Chemical Bonding in Excited States: Energy Transfer and Charge Redistribution from a Real Space Perspective

  • Jara-Cortes, J
  • Guevara-Vela, JM
  • Pendas, AM
  • Hernandez-Trujillo, J

Journal Of Computational Chemistry (p. 957-970) - 15/5/2017

10.1002/jcc.24769 View at source

  • ISSN 01928651

Computation of photovoltaic and stability properties of hybrid organic-inorganic perovskites via convolutional neural networks

  • Aristizabal-Ferreira, VA
  • Guevara-Vela, JM
  • Sauza-de la Vega, A
  • Pendas, AM
  • Fuentes-Pineda, G
  • Rocha-Rinza, T

Theoretical Chemistry Accounts - 1/4/2022

10.1007/s00214-022-02875-9 View at source

  • ISSN 1432881X

Continuous intercalation compound fibers of bromine wires and aligned CNTs for high-performance conductors

  • Madrona, C
  • Hong, SK
  • Lee, D
  • Garcia-Perez, J
  • Guevara-Vela, JM
  • Gavito, RB
  • Mikhalchan, A
  • Llorca, J
  • Ku, BC
  • Granados, D
  • Hwang, JY
  • Vilatela, JJ
... View more Collapse

Carbon (p. 211-218) - 1/1/2023

10.1016/j.carbon.2022.12.041 View at source

  • ISSN 00086223

Cooperative and anticooperative effects in resonance assisted hydrogen bonds in merged structures of malondialdehyde

  • Romero-Montalvo, E
  • Guevara-Vela, JM
  • Costales, A
  • Pendas, AM
  • Rocha-Rinza, T

Physical Chemistry Chemical Physics (p. 97-107) - 7/1/2017

10.1039/c6cp04877c View at source

  • ISSN 14639076

Cooperativity and Anticooperativity in Ion-Water Interactions: Implications for the Aqueous Solvation of Ions

  • Sauza-de la, VA
  • Rocha-Rinza, T
  • Guevara-Vela, JM

Chemphyschem (p. 1269-1285) - 16/6/2021

10.1002/cphc.202000981 View at source

  • ISSN 14394235

This researcher has no books.

Applications of the quantum theory of atoms in molecules and the interacting quantum atoms methods to the study of hydrogen bonds

  • Guevara-Vela JM
  • Fernández-Alarcón A
  • Rocha-Rinza T

Advances In Quantum Chemical Topology Beyond Qtaim (p. 431-468) - 1/1/2022

10.1016/b978-0-323-90891-7.00010-4 View at source

Emergent Scalar and Vector Fields in Quantum Chemical Topology

  • Pendas, AM
  • Francisco, E
  • Bueno, AG
  • Vela, JMG
  • Costales, A

APPLICATIONS OF TOPOLOGICAL METHODS IN MOLECULAR CHEMISTRY (p. 131-150) - 1/1/2016

10.1007/978-3-319-29022-5_6 View at source

This researcher has no conferences.

This researcher has no working papers.

This researcher has no technical reports.

This researcher has no research projects.

This researcher has no supervised thesis.

This researcher has no patents or software licenses.

Last data update: 3/19/24 12:52 AM