hauser-group Goto Github PK
Name: Hauser Group
Type: Organization
Bio: Computational Chemistry and Molecular Physics research performed at TU Graz
Location: Graz, Austria
Name: Hauser Group
Type: Organization
Bio: Computational Chemistry and Molecular Physics research performed at TU Graz
Location: Graz, Austria
Machine learned embedded atom models for metallic nanoparticles
ML tools for potential energy surface fitting
Orbital-free Density Functional Theory in 1D
A Python module for scripting with Q-Chem
Partition sum calculator for molecular pore propagation scenarios
A declarative, efficient, and flexible JavaScript library for building user interfaces.
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