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ATLJ.getEnergy()

pele /
Potentials (pele.potentials) /
pele.potentials.ATLJ.ATLJ /
pele.potentials.ATLJ.ATLJ.getEnergy

pele.potentials.ATLJ.ATLJ.getEnergy#

ATLJ.getEnergy(coords)[source]#: return the energy at the given coordinates

pele.potentials.ATLJ.ATLJ.NumericalHessian

pele.potentials.ATLJ.ATLJ.getEnergyFortran

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