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FreezePot.getHessian()

pele /
Utilities (pele.utils) /
pele.utils.frozen_atoms.FreezePot /
pele.utils.frozen_atoms.FreezePot.getHessian

pele.utils.frozen_atoms.FreezePot.getHessian#

FreezePot.getHessian(coords)[source]#: return the hessian

pele.utils.frozen_atoms.FreezePot.getGradient

pele.utils.frozen_atoms.FreezePot.get_1d_indices

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