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Project Summary

ANUChem is a collection of computational chemistry codes written in the X10 programming language. These include:
* Pumja Rasaayani (Quantum Chemistry): energy calculation using the Hartree-Fock SCF method;
* FMM: electrostatics calculation (for molecular dynamics) using the Fast Multipole method; and
* PME: electrostatics calculation using the Smooth Particle Mesh Ewald method.

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apgas chemistry x10

In a Nutshell, ANUChem...

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 Code analysis has not completed

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