Detalhe da pesquisa
1.
A data-science approach to predict the heat capacity of nanoporous materials.
Nat Mater
; 21(12): 1419-1425, 2022 12.
Artigo
em Inglês
| MEDLINE | ID: mdl-36229651
2.
Toward Optimal Photocatalytic Hydrogen Generation from Water Using Pyrene-Based Metal-Organic Frameworks.
ACS Appl Mater Interfaces
; 13(48): 57118-57131, 2021 Dec 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-34817166
3.
Evaluating Charge Equilibration Methods To Generate Electrostatic Fields in Nanoporous Materials.
J Chem Theory Comput
; 15(1): 382-401, 2019 Jan 08.
Artigo
em Inglês
| MEDLINE | ID: mdl-30419163