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José Manuel Guevara-Vela
José Manuel Guevara-Vela
Подтвержден адрес электронной почты в домене uam.es - Главная страница
Название
Процитировано
Процитировано
Год
Hydrogen bond cooperativity and anticooperativity within the water hexamer
JM Guevara-Vela, E Romero-Montalvo, VAM Gómez, R Chávez-Calvillo, ...
Physical Chemistry Chemical Physics 18 (29), 19557-19566, 2016
1222016
Hydrogen‐Bond Cooperative Effects in Small Cyclic Water Clusters as Revealed by the Interacting Quantum Atoms Approach
JM Guevara‐Vela, R Chávez‐Calvillo, M García‐Revilla, ...
Chemistry–A European Journal 19 (42), 14304-14315, 2013
972013
Interacting quantum atoms—a review
JM Guevara-Vela, E Francisco, T Rocha-Rinza, Á Martín Pendás
Molecules 25 (17), 4028, 2020
712020
The nature of resonance-assisted hydrogen bonds: A quantum chemical topology perspective
JM Guevara-Vela, E Romero-Montalvo, A Costales, ÁM Pendás, ...
Physical Chemistry Chemical Physics 18 (38), 26383-26390, 2016
712016
Cooperative and anticooperative effects in resonance assisted hydrogen bonds in merged structures of malondialdehyde
E Romero-Montalvo, JM Guevara-Vela, A Costales, ÁM Pendás, ...
Physical Chemistry Chemical Physics 19 (1), 97-107, 2017
352017
Chemical bonding in excited states: Energy transfer and charge redistribution from a real space perspective
J Jara‐Cortés, JM Guevara‐Vela, Á Martín Pendás, J Hernández‐Trujillo
Journal of Computational Chemistry 38 (13), 957-970, 2017
342017
On the strength of hydrogen bonding within water clusters on the coordination limit
VM Castor‐Villegas, JM Guevara‐Vela, WE Vallejo Narvaez, ...
Journal of Computational Chemistry 41 (26), 2266-2277, 2020
252020
The bifunctional catalytic role of water clusters in the formation of acid rain
E Romero-Montalvo, JM Guevara-Vela, WEV Narváez, A Costales, ...
Chemical communications 53 (25), 3516-3519, 2017
252017
Where does electron correlation lie? Some answers from a real space partition
JL Casalz‐Sainz, JM Guevara‐Vela, E Francisco, T Rocha‐Rinza, ...
ChemPhysChem 18 (24), 3553-3561, 2017
232017
Halogen bonds in clathrate cages: a real space perspective
JM Guevara‐Vela, D Ochoa‐Resendiz, A Costales, ...
ChemPhysChem 19 (19), 2512-2517, 2018
222018
Hydrogen‐Bond Weakening through π Systems: Resonance‐Impaired Hydrogen Bonds (RIHB)
JM Guevara‐Vela, E Romero‐Montalvo, A del Río‐Lima, A Martin Pendas, ...
Chemistry–A European Journal 23 (65), 16605-16611, 2017
202017
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
192020
Valence shell charge concentration (VSCC) evolution: a tool to investigate the transformations within a VSCC throughout a chemical reaction
F Cortés-Guzmán, RM Gómez, T Rocha-Rinza, MA Sánchez-Obregón, ...
The Journal of Physical Chemistry A 115 (45), 12924-12932, 2011
192011
On the relationship between hydrogen bond strength and the formation energy in resonance-assisted hydrogen bonds
JM Guevara-Vela, M Gallegos, MA Valentín-Rodríguez, A Costales, ...
Molecules 26 (14), 4196, 2021
182021
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
182019
An unexpected bridge between chemical bonding indicators and electrical conductivity through the localization tensor
ÁM Pendás, JM Guevara-Vela, DM Crespo, A Costales, E Francisco
Physical Chemistry Chemical Physics 19 (3), 1790-1797, 2017
172017
Directing the crystal packing in triphenylphosphine gold (I) thiolates by ligand fluorination
G Moreno-Alcántar, L Turcio-García, JM Guevara-Vela, ...
Inorganic chemistry 59 (13), 8667-8677, 2020
132020
Atoms in molecules in real space: a fertile field for chemical bonding
ÁM Pendás, E Francisco, D Suárez, A Costales, N Díaz, J Munárriz, ...
Physical Chemistry Chemical Physics 25 (15), 10231-10262, 2023
102023
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
102019
Dynamic Molecular Graphs:“Hopping” Structures
F Cortés‐Guzmán, T Rocha‐Rinza, JM Guevara‐Vela, G Cuevas, ...
Chemistry–A European Journal 20 (19), 5665-5672, 2014
102014
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