Simulations of molecular photodynamics in long timescales

por Mukherjee, Saikat, Pinheiro, Max, Demoulin, Baptiste, Barbatti, Mario
Publicado 2022

Temperature effects on the internal conversion of excited adenine and adenosine

por Mansour, Ritam, Toldo, Josene M., Mukherjee, Saikat, Pinheiro, Max, Barbatti, Mario
Publicado 2023

Choosing the right molecular machine learning potential

por Pinheiro, Max, Ge, Fuchun, Ferré, Nicolas, Dral, Pavlo O., Barbatti, Mario
Publicado 2021

Modeling the heating and cooling of a chromophore after photoexcitation

por Ventura, Elizete, Andrade do Monte, Silmar, T. do Casal, Mariana, Pinheiro, Max, Toldo, Josene Maria, Barbatti, Mario
Publicado 2022

Correction: Modeling the heating and cooling of a chromophore after photoexcitation

por Ventura, Elizete, do Monte, Silmar Andrade, do Casal, Mariana T., Pinheiro, Max, Toldo, Josene Maria, Barbatti, Mario
Publicado 2022

MLatom 2: An Integrative Platform for Atomistic Machine Learning

por Dral, Pavlo O., Ge, Fuchun, Xue, Bao-Xin, Hou, Yi-Fan, Pinheiro, Max, Huang, Jianxing, Barbatti, Mario
Publicado 2021