"From small fullerenes to the graphene limit: A harmonic force-field method ..."

Lukas N. Wirz et al. (2016)

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DOI: 10.1002/JCC.23894

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type: Journal Article

metadata version: 2024-04-11

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Lukas N. Wirz, Ralf Tonner, Andreas Hermann, Rebecca Sure, Peter Schwerdtfeger:
From small fullerenes to the graphene limit: A harmonic force-field method for fullerenes and a comparison to density functional calculations for Goldberg-Coxeter fullerenes up to C₉₈₀. J. Comput. Chem. 37(1): 10-17 (2016)

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