SEEK ID: https://publications.h-its.org/people/194
Location: Germany
ORCID: https://orcid.org/0000-0002-5341-3066
Joined: 9th Aug 2023
Expertise: Not specified
Tools: Not specified
Related items
Public web page: http://www.simplaix.org
Organisms: Not specified
The Computational Carbon Chemistry (CCC) group uses state-of-the-art computational chemistry to explore and exploit diverse functional organic materials. Among these, graphene-based materials are of particular interest due to a number of advantages they offer over conventional inorganic counterparts: natural biocompatibility, infinite structural variability, mechanical flexibility, unique electronic and optical properties, relative ease of fabrication and functionalisation, and inherent molecular ...
Public web page: https://www.h-its.org/research/ccc/
Start date: 1st Apr 2019
End date: 31st Mar 2024
Organisms: Not specified
Abstract (Expand)
Authors: Rostislav Fedorov, Ganna Gryn’ova
Date Published: 8th Aug 2023
Publication Type: Journal
Citation: J. Chem. Theory Comput. 19(15):4796-4814