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Molecular Simulation· 2015Q3

RASPA: molecular simulation software for adsorption and diffusion in flexible nanoporous materials

David Dubbeldam, Sofı́a Calero, D. E. Ellis, Randall Q. Snurr

Short summary

RASPA is a new, open-source software package designed for molecular simulations of adsorption and diffusion in flexible nanoporous materials.

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Field: Inorganic Chemistry

Inorganic ChemistryChemistry