| Dative and Electron‐Sharing Bonding in C2F4 DM Andrada, JL Casals‐Sainz, Á Martín Pendás, G Frenking Chemistry–A European Journal 24 (36), 9083-9089, 2018 | 75 | 2018 |
| Partitioning the DFT exchange-correlation energy in line with the interacting quantum atoms approach E Francisco, JL Casals-Sainz, T Rocha-Rinza, A Martín Pendás Theoretical Chemistry Accounts 135, 1-8, 2016 | 56 | 2016 |
| On electrostatics, covalency, and chemical dashes: Physical interactions versus chemical bonds AM Pendás, JL Casals‐Sainz, E Francisco Chemistry–A European Journal 25 (1), 309-314, 2019 | 35 | 2019 |
| Bond order densities in real space JL Casals-Sainz, A Fernández-Alarcón, E Francisco, A Costales, ... The Journal of Physical Chemistry A 124 (2), 339-352, 2019 | 33 | 2019 |
| Enlisting potential cathode materials for rechargeable Ca batteries A Torres, JL Casals, ME Arroyo-de Dompablo Chemistry of Materials 33 (7), 2488-2497, 2021 | 25 | 2021 |
| Beryllium bonding in the light of modern quantum chemical topology tools JL Casals-Sainz, F Jiménez-Grávalos, A Costales, E Francisco, ... The Journal of Physical Chemistry A 122 (3), 849-858, 2018 | 25 | 2018 |
| Where does electron correlation lie? Some answers from a real space partition JL Casals‐Sainz, JM Guevara‐Vela, E Francisco, T Rocha‐Rinza, ... ChemPhysChem 18 (24), 3553-3561, 2017 | 23 | 2017 |
| Efficient implementation of the interacting quantum atoms energy partition of the second‐order Møller–Plesset energy JL Casals‐Sainz, JM Guevara‐Vela, E Francisco, T Rocha‐Rinza, ... Journal of computational chemistry 41 (13), 1234-1241, 2020 | 19 | 2020 |
| Partition of electronic excitation energies: the IQA/EOM-CCSD method A Fernández-Alarcón, JL Casals-Sainz, JM Guevara-Vela, A Costales, ... Physical Chemistry Chemical Physics 21 (25), 13428-13439, 2019 | 18 | 2019 |
| Tetrel interactions from an interacting quantum atoms perspective JL Casals-Sainz, A Costales Castro, E Francisco, A Martin Pendas Molecules 24 (12), 2204, 2019 | 12 | 2019 |
| The activation strain model in the light of real space energy partitions JL Casals‐Sainz, E Francisco, A Martin Pendas Zeitschrift für anorganische und allgemeine Chemie 646 (14), 1062-1072, 2020 | 10 | 2020 |
| Exotic bonding regimes uncovered in excited states JL Casals‐Sainz, J Jara‐Cortés, J Hernández‐Trujillo, JM Guevara‐Vela, ... Chemistry–A European Journal 25 (52), 12169-12179, 2019 | 10 | 2019 |
| Photochemistry in Real Space: Batho‐and Hypsochromism in the Water Dimer A Fernández‐Alarcón, JM Guevara‐Vela, JL Casals‐Sainz, A Costales, ... Chemistry–A European Journal 26 (71), 17035-17045, 2020 | 8 | 2020 |
| Electron-pair bonding in real space. Is the charge-shift family supported? JL Casals-Sainz, F Jiménez-Grávalos, E Francisco, ÁM Pendás Chemical communications 55 (35), 5071-5074, 2019 | 8 | 2019 |
| DFT performance in the IQA energy partition of small water clusters F Jiménez-Grávalos, JL Casals-Sainz, E Francisco, T Rocha-Rinza, ... Theoretical Chemistry Accounts 139 (1), 5, 2020 | 6 | 2020 |
| Electronegativity equalization: taming an old problem with new tools JL Casals-Sainz, E Francisco, AM Pendás Physical Chemistry Chemical Physics 22 (40), 22880-22884, 2020 | 4 | 2020 |
| The nature of the intermolecular interaction in (H 2 X) 2 (X= O, S, Se) A Fernández-Alarcón, JM Guevara-Vela, JL Casals-Sainz, E Francisco, ... Physical Chemistry Chemical Physics 23 (16), 10097-10107, 2021 | 3 | 2021 |
| Chemical Bonding in Excited States: Electron Localization, Delocalization and Statistics in Real Space JL Casals-Sainz, J Jara-Cortés, J Hernández-Trujillo, JM Guevara-Vela, ... | 1 | 2019 |
| Front Cover: Photochemistry in Real Space: Batho‐and Hypsochromism in the Water Dimer (Chem. Eur. J. 71/2020) A Fernández‐Alarcón, JM Guevara‐Vela, JL Casals‐Sainz, A Costales, ... Chemistry–A European Journal 26 (71), 16947-16947, 2020 | | 2020 |
| (Invited) Recent Advances in the DFT-Based Search of Cathode Materials for Ca Batteries A Torres, JL Casals, J Luque, J Tortajada, ME Arroyo-de Dompablo Electrochemical Society Meeting Abstracts aimes2018, 517-517, 2018 | | 2018 |
Ángel Martín PendásProfesor de Química Física (UOV)Dirección de correo verificada de uniovi.es
