Adaptively Accelerating Reactive Molecular Dynamics Using Boxed Molecular Dynamics in Energy Space

Document Details

Document Type
Pub Defense Publication
Publication Date
Jul 25, 2018
Source ID
10.1021/acs.jctc.8b00515

Entities

People

  • David R Glowacki
  • Dmitrii V Shalashilin
  • Mike O’connor
  • Robin Shannon
  • Silvia Amabilino

Organizations

  • Air Force Office of Scientific Research
  • Engineering and Physical Sciences Research Council
  • Royal Society
  • Royal Society of Chemistry
  • Stanford University
  • University of Bristol
  • University of Leeds

Tags

Technology Areas

  • Space