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Medrano Sandonas, Leonardo
70
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Format
Online (70)
Mediatypes
Articles (Online) (32)
OpenAccess-fulltext (37)
Thesis (Online) (1)
Languages
english (57)
spanish (2)
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1
Inverse mapping of quantum properties to structures for che..:
Fallani, Alessio
;
Medrano Sandonas, Leonardo
;
Tkatchenko, Alexandre
Nature Communications. 15 (2024) 1 - p. , 2024
Link:
https://doi.org/10.1038/..
?
2
Dataset for quantum-mechanical exploration of conformers an..:
Medrano Sandonas, Leonardo
;
Van Rompaey, Dries
;
Fallani, Alessio
...
Scientific Data. 11 (2024) 1 - p. , 2024
Link:
https://doi.org/10.1038/..
?
3
Functionalization-Induced Local Magnetization in Black Phos..:
Rodríguez Méndez, Álvaro
;
Dianat, Arezoo
;
Medrano Sandonas, Leonardo
..
The Journal of Physical Chemistry C. 127 (2023) 27 - p. 13157-13166 , 2023
Link:
https://doi.org/10.1021/..
?
4
Dithienylethene‐Based Single Molecular Photothermal Linear ..:
Rashid, Umar
;
Chatir, Elarbi
;
Medrano Sandonas, Leonardo
...
Angewandte Chemie International Edition. 62 (2023) 16 - p. , 2023
Link:
https://doi.org/10.1002/..
?
5
Equivariant Graph Neural Networks for Toxicity Prediction:
Cremer, Julian
;
Medrano Sandonas, Leonardo
;
Tkatchenko, Alexandre
..
Chemical Research in Toxicology. , 2023
Link:
https://doi.org/10.1021/..
?
6
Dithienylethene‐Based Single Molecular Photothermal Linear ..:
Rashid, Umar
;
Chatir, Elarbi
;
Medrano Sandonas, Leonardo
...
Angewandte Chemie. 135 (2023) 16 - p. , 2023
Link:
https://doi.org/10.1002/..
?
7
Molecules in Environments: Toward Systematic Quantum Embedd..:
Ditte, Matej
;
Barborini, Matteo
;
Medrano Sandonas, Leonardo
.
Physical Review Letters. 131 (2023) 22 - p. , 2023
Link:
https://doi.org/10.1103/..
?
8
"Freedom of design" in chemical compound space: towards rat..:
Medrano Sandonas, Leonardo
;
Hoja, Johannes
;
Ernst, Brian G.
...
Chemical Science. 14 (2023) 39 - p. 10702-10717 , 2023
Link:
https://doi.org/10.1039/..
?
9
Electronic and thermal signatures of phosphorene grain boun..:
Rodríguez Méndez, Álvaro
;
Medrano Sandonas, Leonardo
;
Dianat, Arezoo
..
Physical Review Materials. 6 (2022) 11 - p. , 2022
Link:
https://doi.org/10.1103/..
?
10
An Atomistic Study of the Thermoelectric Signatures of CNT ..:
Rodríguez Méndez, Álvaro
;
Medrano Sandonas, Leonardo
;
Dianat, Arezoo
..
The Journal of Physical Chemistry C. 125 (2021) 25 - p. 13721-13731 , 2021
Link:
https://doi.org/10.1021/..
?
11
QM7-X, a comprehensive dataset of quantum-mechanical proper..:
Hoja, Johannes
;
Medrano Sandonas, Leonardo
;
Ernst, Brian G.
...
Scientific Data. 8 (2021) 1 - p. , 2021
Link:
https://doi.org/10.1038/..
?
12
Nanoscale Phononic Analog of the Ranque-Hilsch Vortex Tube:
Medrano Sandonas, Leonardo
;
Rodríguez Méndez, Álvaro
;
Gutierrez, Rafael
..
Physical Review Applied. 15 (2021) 3 - p. , 2021
Link:
https://doi.org/10.1103/..
?
13
Accurate Many-Body Repulsive Potentials for Density-Functio..:
Stöhr, Martin
;
Medrano Sandonas, Leonardo
;
Tkatchenko, Alexandre
The Journal of Physical Chemistry Letters. 11 (2020) 16 - p. 6835-6843 , 2020
Link:
https://doi.org/10.1021/..
?
14
Exploring the write-in process in molecular quantum cellula..:
Santana-Bonilla, Alejandro
;
Medrano Sandonas, Leonardo
;
Gutierrez, Rafael
.
Journal of Physics: Condensed Matter. 31 (2019) 40 - p. 405502 , 2019
Link:
https://doi.org/10.1088/..
?
15
Electron Transport through Self-Assembled Monolayers of Tri..:
Mervinetsky, Evgeniy
;
Alshanski, Israel
;
Lenfant, Stephane
...
The Journal of Physical Chemistry C. 123 (2019) 14 - p. 9600-9608 , 2019
Link:
https://doi.org/10.1021/..
1-15