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Volumn 176, Issue 4, 2007, Pages 292-299

Pathfinder: A parallel search algorithm for concerted atomistic events

Author keywords

Molecular dynamics; Parallel computing; Transition state theory

Indexed keywords

ACTIVATION ENERGY; ALUMINA; ATOMIC PHYSICS; EIGENVALUES AND EIGENFUNCTIONS; ELECTRON ENERGY LEVELS; MOLECULAR DYNAMICS; PARALLEL PROCESSING SYSTEMS;

EID: 33846526837     PISSN: 00104655     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.cpc.2006.11.003     Document Type: Article
Times cited : (7)

References (44)
  • 3
    • 0003749418 scopus 로고
    • Cambridge University Press, Cambridge, UK
    • Lawn B. Fracture of Brittle Solids (1993), Cambridge University Press, Cambridge, UK
    • (1993) Fracture of Brittle Solids
    • Lawn, B.1
  • 32
    • 33846495260 scopus 로고    scopus 로고
    • We compute the minimum Hessian eigenvalue of the final state to check if it is a local energy minimum
  • 43
    • 33745032191 scopus 로고    scopus 로고
    • Sickafus K.E., Kotomin E.A., and Uberuaga B.P. (Eds), Springer, Dordrecht, The Netherlands
    • Voter A.F. In: Sickafus K.E., Kotomin E.A., and Uberuaga B.P. (Eds). Radiation Effects in Solids (2006), Springer, Dordrecht, The Netherlands
    • (2006) Radiation Effects in Solids
    • Voter, A.F.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.