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cagrikymk / JAX-ReaxFF

JAX-ReaxFF: A Gradient Based Framework for Extremely Fast Optimization of Reactive Force Fields
GNU General Public License v3.0
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Major Update: jax-reaxff v0.2 #17

Closed cagrikymk closed 4 months ago

cagrikymk commented 4 months ago

Update the code in the main branch with jax-reaxff v0.2