Category:
Theoretical and Computational Chemistry
,
Working Paper
, Title:
Assessment of free energies from electrostatic embedding density functional tight binding-based/molecular mechanics in periodic boundary conditions
, Authors:
Simone Bonfrate, Woojin Park, Dulce Trejo-Zamora, Nicolas Ferré, Cheol Ho Choi, Miquel Huix-Rotllant
Version 1 posted 07 October 2024
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