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Atomistic simulations of materials for optical chemical sensors: DFT-D calculations of molecular interactions between gas-phase analyte molecules and simple substrate models
Andrey A. Safonov, Elena A. Rykova, Alexander A. Bagaturyants, Vyacheslav A. Sazhnikov, Michael V. AlfimovVolume:
17
Language:
english
Pages:
8
DOI:
10.1007/s00894-010-0882-6
Date:
August, 2011
File:
PDF, 435 KB
english, 2011