Electronic Structure Laboratory

Gygi Research Group at UC Davis. Welcome to the Electronic Structure Laboratory at the University of California Davis. Our research focuses on the development of numerical algorithms and high-performance software for electronic structure computations and First-Principles Molecular Dynamics FPMD simulations. DOE creates the Midwest Center for Computational Materials MICCoM at Argonne National Laboratory. The course ECS289K Introduction to Quantum Simulations. And the Qbox source repository. We are dev.

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Electronic Structure Laboratory

We provide a table of atomic potentials. For use in first-principles molecular dynamics simulations. Potentials are accessible in XML form for XML-aware software packages. We are building a collection of reference data. For validation and verification of first-principles simulation programs. We provide examples of Qbox simulations for selected simulation projects.

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128.120.80.57

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SITE TITLE

Electronic Structure Laboratory

DESCRIPTION

Gygi Research Group at UC Davis. Welcome to the Electronic Structure Laboratory at the University of California Davis. Our research focuses on the development of numerical algorithms and high-performance software for electronic structure computations and First-Principles Molecular Dynamics FPMD simulations. DOE creates the Midwest Center for Computational Materials MICCoM at Argonne National Laboratory. The course ECS289K Introduction to Quantum Simulations. And the Qbox source repository. We are dev.

PARSED CONTENT

The web site eslab.ucdavis.edu has the following on the site, "Gygi Research Group at UC Davis." I noticed that the webpage also said " Welcome to the Electronic Structure Laboratory at the University of California Davis." They also said " Our research focuses on the development of numerical algorithms and high-performance software for electronic structure computations and First-Principles Molecular Dynamics FPMD simulations. DOE creates the Midwest Center for Computational Materials MICCoM at Argonne National Laboratory. The course ECS289K Introduction to Quantum Simulations. And the Qbox source repository." The meta header had Gygi electronic structure quantum simulation first-principles molecular dynamics FPMD as the first optimized keyword.

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