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Article #8576Atom Number/Time Range of Simulation Methods
From: mgs7885
Date: Mon, 18 Jan 1999 00:00
Date: Mon, 18 Jan 1999 00:00
19 lines
1588 bytes
1588 bytes
Hello,
Where might I obtain information about current
ranges of atoms and time for different simulation
methods? That is, molecular dynamics simulations might
reasonably be used for models having between 10 and
(say) 10,000 atoms, in a time scale range of (again,
say) 10 femto seconds to 100 picoseconds. What are
the average values for ab initio, bond order, tight
binding, molecular dynamics, monte carlo, and finite
element simulations? Do these values differ if one studies
polymers versus proteins versus semiconductors? What are
the most current high end figures for such simulations on
supercomputers? Does any organization track the
values? Many questions. Thanks much for the help!
Sincerely,
M. Schaible
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X-Google-Language: ENGLISH,ASCII-7-bit X-Google-Thread: 10b271,a6a0050901019ec8,start X-Google-Attributes: gid10b271,public X-Google-Thread: f803e,a6a0050901019ec8,start X-Google-Attributes: gidf803e,public From: mgs7885@rit.edu Subject: Atom Number/Time Range of Simulation Methods Date: 1999/01/18 Message-ID: <77vhuk$nsa$1@nnrp1.dejanews.com> X-Deja-AN: 433986436 X-Http-Proxy: 1.0 x7.dejanews.com:80 (Squid/1.1.22) for client 129.21.176.7 Organization: Deja News - The Leader in Internet Discussion X-Article-Creation-Date: Mon Jan 18 14:54:17 1999 GMT Newsgroups: sci.physics,bionet.info-theory X-Http-User-Agent: Mozilla/4.08 [en] (WinNT; U)