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Quantum Chemistry An open source computational chemistry program that efficiently handles large-scale computational chemistry problems NWChem
HPC Systems Co., Ltd.

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NWChem is an open source computational chemistry program that efficiently handles large-scale computational chemistry problems. It is being developed at the Environment Molecular Science Laboratory (EMSL) at the Pacific Northwest National Laboratory (PNNL) to study the mechanics of chemical transformations and the chemistry of interfaces and condensed phases. It is known for its high parallel efficiency, scaling to thousands of processors with computational performance of tens of TFLOPS. Targets include large-scale systems, such as biopolymers, nanostructured materials, and solids. It can be treated using classical mechanics and quantum mechanics, and it is also possible to include relativistic effects.

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    Quantum Chemistry An open source computational chemistry program that efficiently handles large-scale computational chemistry problems NWChem

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