Nonlinear instability in multiple time stepping molecular dynamics

Proceedings of the ACM Symposium on Applied Computing

Volumn , Issue , 2003, Pages 167-171

  Ma, Qun ^a   Izaguirre, Jesús A ^a   Skeel, Robert D ^b  

^a University of Notre Dame   (United States)

^b University of Illinois at Urbana Champaign   (United States)

Author keywords

Linear instability; Long molecular dynamics simulations; Multiple time stepping; Nonlinear instability; Verlet I r RESPA Impulse

Indexed keywords

COMPUTER SIMULATION; EQUATIONS OF MOTION; POTENTIAL ENERGY; RESONANCE; VECTORS;

MULTIPLE TIME STEPPING (MTS);

MOLECULAR DYNAMICS;

EID: 0037999103     PISSN: None     EISSN: None     Source Type: Conference Proceeding    
DOI: 10.1145/952532.952568     Document Type: Conference Paper

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