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A heuristic derivation of an improved analytical theory for perpendicular diffusion of charged particles

โœ Scribed by A. Shalchi


Book ID
113471205
Publisher
Elsevier Science
Year
2011
Tongue
English
Weight
219 KB
Volume
48
Category
Article
ISSN
0273-1177

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An improved algorithm for analytical gra
โœ Robert A. Distasio JR.; Ryan P. Steele; Young Min Rhee; Yihan Shao; Martin Head- ๐Ÿ“‚ Article ๐Ÿ“… 2007 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 391 KB ๐Ÿ‘ 2 views

## Abstract We present a new algorithm for analytical gradient evaluation in resolutionโ€ofโ€theโ€identity secondโ€order Mรธllerโ€Plesset perturbation theory (RIโ€MP2) and thoroughly assess its computational performance and chemical accuracy. This algorithm addresses the potential I/O bottlenecks associat