Driven Dynamics of Long-Time Bond-Breaking Events
We present a predict-correct trajectory propagation (PCTP) method for simulating nonequilibrium driven dynamics of the long-time bond-breaking event in an atomic force microscope (AFM). Whereas the parallel replica method can extend the time scale of molecular dynamics (MD) simulations of infrequent...
| Publié dans: | Langmuir : the ACS journal of surfaces and colloids. - 1985. - 35(2019), 51 vom: 24. Dez., Seite 16961-16968 |
|---|---|
| Auteur principal: | |
| Autres auteurs: | |
| Format: | Article en ligne |
| Langue: | English |
| Publié: |
2019
|
| Accès à la collection: | Langmuir : the ACS journal of surfaces and colloids |
| Sujets: | Journal Article |
| Accès en ligne |
Volltext |