Phonon anharmonicity analysis from molecular dynamics
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Oct 23, 2026 - Python
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anharmonicity
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A suite of programs for molecular vibrational analyses
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Apr 23, 2026 - HTML
Python package for computing thermochemical properties of molecules and solids in the anharmonic approximation.
python entropy chemistry molecules thermochemistry vibrations anharmonicity solid-state-chemistry enthalpy
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Aug 7, 2023 - Python
A Computational Approach to Sustainable Nitrogen Fixation.
antenna terahertz velocity-verlet plasmonics nanotechnology co2-emissions anharmonicity vacuum-tube computational-materials-engineering academic-research resonant-frequency bond-dissociation-energy sustainable-agriculture nitrogen-fixation morse-potential green-ammonia dinitrogen haber-bosch molecular-force-controller proton-conducting-membrane
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May 28, 2026 - SystemVerilog
Simple pendulum period for large amplitude with quadractic friction
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Oct 12, 2026 - JavaScript
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