I agree that this site is using cookies. You can find further informations here.
X
Valdés, Álvaro
485  results:
Search for persons X
?
1

A kernel-based machine learning potential and quantum vibra..:

Montes de Oca-Estévez, María Judit ; Valdés, Álvaro ; Prosmiti, Rita
Physical Chemistry Chemical Physics.  26 (2024)  8 - p. 7060-7071 , 2024
Link: https://doi.org/10.1039/..
 
?
2

CO2 inside sI clathrate-like cages: Automated construction ..:

Valdés, Álvaro ; Prosmiti, Rita
The Journal of Chemical Physics.  160 (2024)  18 - p. , 2024
Link: https://doi.org/10.1063/..
 
?
3

Confining CO2 inside sI clathrate‐hydrates: The impact of t..:

Valdés, Álvaro ; Cabrera‐Ramírez, Adriana ; Prosmiti, Rita
Journal of Computational Chemistry.  44 (2023)  17 - p. 1587-1598 , 2023
Link: https://doi.org/10.1002/..
 
?
4

Computational Energy Spectra of the H2O@C70 Endofullerene:

Carrillo‐Bohórquez, Orlando ; Valdés, Álvaro ; Prosmiti, Rita
ChemPhysChem.  24 (2023)  23 - p. , 2023
Link: https://doi.org/10.1002/..
 
?
5

First report of a carbapenemase OXA-48-producing Hafnia alv..:

Sevillano, Laura ; Herrera, Cristhian ; Valdes, Álvaro...
Access Microbiology.  5 (2023)  6 - p. , 2023
Link: https://doi.org/10.1099/..
 
?
6

Unraveling the Origin of Symmetry Breaking in H2O@C60 Endof..:

Carrillo‐Bohórquez, Orlando ; Valdés, Álvaro ; Prosmiti, Rita
ChemPhysChem.  23 (2022)  9 - p. , 2022
Link: https://doi.org/10.1002/..
 
?
7

Encapsulation of a Water Molecule inside C60 Fullerene: The..:

Carrillo-Bohórquez, Orlando ; Valdés, Álvaro ; Prosmiti, Rita
Journal of Chemical Theory and Computation.  17 (2021)  9 - p. 5839-5848 , 2021
Link: https://doi.org/10.1021/..
 
?
8

Exploring CO2@sI Clathrate Hydrates as CO2 Storage Agents b..:

Cabrera‐Ramírez, Adriana ; Arismendi‐Arrieta, Daniel J. ; Valdés, Álvaro.
ChemPhysChem.  22 (2021)  4 - p. 359-369 , 2021
Link: https://doi.org/10.1002/..
 
?
9

Structural Stability of the CO2@sI Hydrate: a Bottom‐Up Qua..:

Cabrera‐Ramírez, Adriana ; Arismendi‐Arrieta, Daniel J. ; Valdés, Álvaro.
ChemPhysChem.  21 (2020)  23 - p. 2618-2628 , 2020
Link: https://doi.org/10.1002/..
 
?
10

The smallest proton-bound dimerH 5 +: theoretical progress:

Prosmiti, Rita ; Valdés, Álvaro
Philosophical Transactions: Mathematical, Physical and Engineering Sciences.  377 (2019)  2154 - p. 1-15 , 2019
Link: https://www.jstor.org/st..
 
?
11

Quantum effects on the stability of the He5I2 van der Waals..:

Valdés, Álvaro ; Prosmiti, Rita
Journal of Computational Chemistry.  40 (2019)  25 - p. 2200-2206 , 2019
Link: https://doi.org/10.1002/..
 
?
12

NOX Inhibition Improves β-Adrenergic Stimulated Contractili..:

Valdés, Álvaro ; Treuer, Adriana V. ; Barrios, Guillermo...
International Journal of Molecular Sciences.  19 (2018)  8 - p. 2404 , 2018
Link: https://doi.org/10.3390/..
 
?
13

A Systematic Protocol for Benchmarking Guest–Host Interacti..:

Arismendi‐Arrieta, Daniel J. ; Valdés, Álvaro ; Prosmiti, Rita
Chemistry – A European Journal.  24 (2018)  37 - p. 9353-9363 , 2018
Link: https://doi.org/10.1002/..
 
?
14

Fully Coupled Quantum Treatment of Nanoconfined Systems: A ..:

Valdés, Álvaro ; Carrillo-Bohórquez, Orlando ; Prosmiti, Rita
Journal of Chemical Theory and Computation.  14 (2018)  12 - p. 6521-6531 , 2018
Link: https://doi.org/10.1021/..
 
?
15

Density-functional approximations on CO2@sI clathrate hydra..:

Arismendi-Arrieta, Daniel J. ; Valdés, Álvaro ; Prosmiti, Rita
Journal of Physics: Conference Series.  875 (2017)  - p. 112015 , 2017
Link: https://doi.org/10.1088/..
 
1-15