Category:
Theoretical and Computational Chemistry
,
Working Paper
, Title:
On-the-fly Non-adiabatic Dynamics Simulations of Single-Walled Carbon Nanotubes with Covalent Defects
, Authors:
Braden Weight, Andrew Sifain, Brendan Gifford, Han Htoon, Sergei Tretiak
Version 1 posted 15 June 2022
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