Sofı́a Calero
- RASPA: molecular simulation software for adsorption and diffusion in flexible nanoporous materials
2015/02/26 by David Dubbeldam, Sofı́a Calero, Sofía Calero +3 · 1,885 citations
Chemistry · Engineering · Materials Science · Mathematics · #Adsorption #Chemistry #Computational chemistry #Computational science #Computer science #Integrator #Kinetic Monte Carlo #Materials science #Mathematics #Mesoporous Materials and Catalysis #Molecular dynamics #Molecule #Monte Carlo method #Nanoporous #Nanotechnology #Phase Equilibria and Thermodynamics #Physical chemistry #Physics #Software #Statistical physics #Zeolite Catalysis and Synthesis