coagulation 发表于 2025-3-30 11:58:33
http://reply.papertrans.cn/43/4279/427839/427839_51.pngMere仅仅 发表于 2025-3-30 13:45:21
Hans-Georg Glasemann,Ingo Korschndard method for obtainingthe electronic structure during a CPMD simulation. QM/MM approaches, which combine the CPMD methodfor a core region with a classical description of its environment, are also reviewed. These schemesprovide a more reliable description of biological systems, whose properties aPantry 发表于 2025-3-30 19:23:51
http://reply.papertrans.cn/43/4279/427839/427839_53.png我悲伤 发表于 2025-3-30 22:20:28
lications for specific materials (such as silicon, copper, fibrous proteins) are provided as case studies for each of the techniques, areas and problems discussed...Providing an extensive review of multi-scale modeling techniques that successfully link atomistic and continuum mechanical methods, .At