Matches in SemOpenAlex for { <https://semopenalex.org/work/W4247194777> ?p ?o ?g. }
Showing items 1 to 69 of
69
with 100 items per page.
- W4247194777 endingPage "648" @default.
- W4247194777 startingPage "629" @default.
- W4247194777 abstract "Molecular dynamics (MD) simulation, in which atom positions are evolved by integrating the classical equations of motion in time, is now a well established and powerful method in materials research. An appealing feature of MD is that it follows the actual dynamical evolution of the system, making no assumptions beyond those in the interatomic potential, which can, in principle, be made as accurate as desired. However, the limitation in the accessible simulation time represents a substantial obstacle in making useful predictions with MD. Resolving individual atomic vibrations — a necessity for maintaining accuracy in the integration — requires time steps on the order of femtoseconds, so that reaching even one microsecond is very difficult on today’s fastest processors. Because this integration is inherently sequential in nature, direct, spatial parallelization does not help significantly; it just allows simulations of nanoseconds on much larger systems." @default.
- W4247194777 created "2022-05-12" @default.
- W4247194777 creator A5010358439 @default.
- W4247194777 creator A5017266374 @default.
- W4247194777 creator A5076312781 @default.
- W4247194777 creator A5085147282 @default.
- W4247194777 date "2005-01-01" @default.
- W4247194777 modified "2023-10-16" @default.
- W4247194777 title "Accelerated Molecular Dynamics Methods" @default.
- W4247194777 doi "https://doi.org/10.1007/1-4020-3286-2_32" @default.
- W4247194777 hasPublicationYear "2005" @default.
- W4247194777 type Work @default.
- W4247194777 citedByCount "2" @default.
- W4247194777 countsByYear W42471947772016 @default.
- W4247194777 crossrefType "book-chapter" @default.
- W4247194777 hasAuthorship W4247194777A5010358439 @default.
- W4247194777 hasAuthorship W4247194777A5017266374 @default.
- W4247194777 hasAuthorship W4247194777A5076312781 @default.
- W4247194777 hasAuthorship W4247194777A5085147282 @default.
- W4247194777 hasBestOaLocation W42471947772 @default.
- W4247194777 hasConcept C11413529 @default.
- W4247194777 hasConcept C121332964 @default.
- W4247194777 hasConcept C121864883 @default.
- W4247194777 hasConcept C138885662 @default.
- W4247194777 hasConcept C17744445 @default.
- W4247194777 hasConcept C199539241 @default.
- W4247194777 hasConcept C2776401178 @default.
- W4247194777 hasConcept C2776650193 @default.
- W4247194777 hasConcept C34742353 @default.
- W4247194777 hasConcept C41008148 @default.
- W4247194777 hasConcept C41895202 @default.
- W4247194777 hasConcept C459310 @default.
- W4247194777 hasConcept C59593255 @default.
- W4247194777 hasConcept C62520636 @default.
- W4247194777 hasConceptScore W4247194777C11413529 @default.
- W4247194777 hasConceptScore W4247194777C121332964 @default.
- W4247194777 hasConceptScore W4247194777C121864883 @default.
- W4247194777 hasConceptScore W4247194777C138885662 @default.
- W4247194777 hasConceptScore W4247194777C17744445 @default.
- W4247194777 hasConceptScore W4247194777C199539241 @default.
- W4247194777 hasConceptScore W4247194777C2776401178 @default.
- W4247194777 hasConceptScore W4247194777C2776650193 @default.
- W4247194777 hasConceptScore W4247194777C34742353 @default.
- W4247194777 hasConceptScore W4247194777C41008148 @default.
- W4247194777 hasConceptScore W4247194777C41895202 @default.
- W4247194777 hasConceptScore W4247194777C459310 @default.
- W4247194777 hasConceptScore W4247194777C59593255 @default.
- W4247194777 hasConceptScore W4247194777C62520636 @default.
- W4247194777 hasLocation W42471947771 @default.
- W4247194777 hasLocation W42471947772 @default.
- W4247194777 hasLocation W42471947773 @default.
- W4247194777 hasLocation W42471947774 @default.
- W4247194777 hasOpenAccess W4247194777 @default.
- W4247194777 hasPrimaryLocation W42471947771 @default.
- W4247194777 hasRelatedWork W1981603286 @default.
- W4247194777 hasRelatedWork W2017394797 @default.
- W4247194777 hasRelatedWork W2082586732 @default.
- W4247194777 hasRelatedWork W2091848301 @default.
- W4247194777 hasRelatedWork W2113361442 @default.
- W4247194777 hasRelatedWork W2136985651 @default.
- W4247194777 hasRelatedWork W2950351524 @default.
- W4247194777 hasRelatedWork W4250983767 @default.
- W4247194777 hasRelatedWork W4254651706 @default.
- W4247194777 hasRelatedWork W4313706048 @default.
- W4247194777 isParatext "false" @default.
- W4247194777 isRetracted "false" @default.
- W4247194777 workType "book-chapter" @default.