Found 8 Documents (Results 1–8)
On an asymptotic method for computing the modified energy for symplectic methods. (English) Zbl 1277.65107
Discretization errors in molecular dynamics simulations with deterministic and stochastic thermostats. (English) Zbl 1202.82002
J. Comput. Phys. 229, No. 24, 9323-9346 (2010); corrigendum ibid. 299, 816 (2015).
A conjecture about molecular dynamics. (English) Zbl 1391.82050
Munthe-Kaas, Hans (ed.) et al., Mathematics and computation, a contemporary view. The Abel symposium 2006. Proceedings of the third Abel symposium, Alesund, Norway, May 25–27, 2006. Berlin: Springer (ISBN 978-3-540-68848-8/hbk). Abel Symposia 3, 95-108 (2008).
Energy drift in molecular dynamics simulations. (English) Zbl 1130.82004
Reviewer: Piotr Garbaczewski (Opole)
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