strain gradient theory free download - SourceForge

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Better time tracking for projects, billing, and payroll
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The Voice API that just works | Twilio
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SMASH

Massively parallel software for quantum chemistry calculations

Scalable Molecular Analysis Solver for High-performance computing systems (SMASH) is massively parallel software for quantum chemistry calculations and released under the Apache 2.0 open source license. It is currently capable of energy, analytical gradient, and geometry optimization calculations of Hartree-Fock theory and Density Functional Theory (DFT), and energy calculations of Second-order Moller-Plesset (MP2) perturbation theory. DFT calculations can be performed on 100,000 CPU cores...

Downloads: 2 This Week

Last Update: 2022-05-09
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