A study by computational simulation of ionic liquids stress heterogeneity
Simulating electronic transport using QM/MM and adaptive Monte Carlo methods: appl...
Hibrid QM/MM methods applied to electronic transport simulations of graphene: appl...
Crystallographic,eletronic and molecular dynamics studies of some Calixarene supra...
Atomistic methods applied to the study of structural and electronic properties of ...
Multiscale computational modeling of the microstructural evolution and plasticity ...
Spectroscopy signal enhancement: nanomaterials, theory, and computer simulation