Accelerated reactive dynamics and automated reaction detection for ReaxFF

Washington, DC / Office of Soc. Services, ACS (2018) [Abstract, Contribution to a book, Contribution to a conference proceedings]

ACS national meeting. - 256
Page(s): 230

Authors

Selected Authors

Goumans, Fedor
Bal, Kristof
Döntgen, Malte
Neyts, Erik
Leonhard, Kai Olaf

Other Authors

Carstensen, Ole
Yakovlev, Alexei
Trnka, Tomas

Identifier

  • REPORT NUMBER: RWTH-2018-229752