Experimental C2DB screening and bilayer-stacking workflow; scientific validation in progress
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Jul 22, 2026 - Python
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ferroelectricity
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Research software portfolio, architecture, roadmap, and maintenance policy
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Jul 22, 2026
This repo, Includes a case study which presents a comprehensive computational investigation into the orientation dependent electromechanical behavior of a single crystal barium titanate (BaTiO3), which is an ferroelectric and piezoelectric material. More details can be found on the README page.
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Jul 20, 2026 - Python
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