Application: chemical-sciences

More-Effective Medicines, Better Batteries, and Greater Control over 3D Parts Creation Could Come in the Era of Exascale Computing

The Exascale Computing Project is building scientific instruments for the gamut of computing devices to advance scientific knowledge and materials design and energy generation.

Comprehensive Molecular Dynamics Capability

The EXAALT project is working to improve molecular dynamics codes and prepare them to exploit the power and performance of exascale.

LBNL, PNNL Researchers Make NWChem’s Planewave “Purr”

  LBNL, PNNL Researchers Make NWChem’s Planewave “Purr” on Intel’s Knights Landing Architectures A team of researchers at the Lawrence Berkeley National Laboratory (Berkeley Lab), Pacific Northwest National Laboratory (PNNL)

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