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14篇 您的检索式:作者名="Menon CS"
    题名 作者 年代 出处 被引量
1Performant implementation of the atomic cluster expansion(PACE)and application to copper and silicon显示文摘The atomic cluster expansion is a general polynomial expansion of the atomic energy in multi-atom basis functions.Here we implement the atomic cluster expansion in the performant C++code PACE that is suitable for use in large-scale atomistic simulations.We briefly review the atomic cluster expansion and give detailed expressions for energies and forces as well as efficient algorithms for their evaluation.We demonstrate that the atomic cluster expansion as implemented in PACE shifts a previously established Pareto front for machine learning interatomic potentials toward faster and more accurate calculations.Moreover,general purpose parameterizations are presented for copper and silicon and evaluated in detail.We show that the Cu and Si potentials significantly improve on the best available potentials for highly accurate large-scale atomistic simulations.Yury Lysogorskiy Cas van der Oord Anton Bochkarev Sarath Menon Matteo Rinaldi Thomas Hammerschmidt Matous Mrovec Aidan Thompson Gábor Csányi Christoph Ortner Ralf Drautz 2021npj Computational Materials2021,,1:3
2Redefining the R1 resection in pancreatic cancer显示文摘Verbeke CS Leitch D Menon KV 2006Br J Surg2006,93,10:1
3Redefining the R1 resection in pancreatic cancer 显示文摘Verbeke CS Leitch D Menon KV 2006Br J Surg2006,93,10:1
4Maxillary expansion cleft lip and palate using quad helix and rapid palatal expansion screw显示文摘Vasant CMR Menon CS Kannan MS 2009MJAFI2009,65,2:1
5Redefining the R1 resection in pancreatic cancer显示文摘Verbeke CS Leitch D Menon KV 0,,10:1
6Redefining the R1 resection in pancreatic cancer显示文摘Verbeke CS Leitch D Menon KV 2006Br J Surg2006,93,10:1
7Redefining the R1 resection in pancreatic cancer显示文摘Verbeke CS Leitch D Menon KV 2006Br J Surg2006,93,10:1
8Redefining the Rl resec- tion in pancreatic cancer 显示文摘Verbeke CS Leitch D Menon KV 2006Br J Surg2006,93,10:1
9Redefining the R1 resection in pancreatic cancer显示文摘Verbeke CS Leitch D Menon KV 2006Br J Surg2006,93,10:1
10Redefining the R1 resection in pancreatic cancer 显示文摘Verbeke CS Leitch D Menon KV 2006Br J Surg2006,93,10:1
11Neuroimaging demonstration of evolving small vessel ischemic injury in cerebral amyloid angiopathy显示文摘Menon RS Kidwell CS 2009Stroke2009,40,:1
12Enzalutamide, a second generation androgen receptor antagonist: development and clinical applications in prostate cancer显示文摘Menon MP Higano CS 2013Curr Oncol Rep2013,15,2:1
13Redefining the R1 resection in pancreatic cancer 显示文摘Verbeke CS Leitch D Menon KV 2006Br J Surg2006,93,10:1
14Enzalutamide, a second generation androgen receptor antagonist: Development and clinical applica tions in prostate cancer显示文摘MENON MP HIGANO CS 2013Curr Oncol Rep2013,15,:1
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