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/dports/science/qmcpack/qmcpack-3.11.0/src/QMCWaveFunctions/tests/
H A Dgaussian_orbitals.py176 def eval_contraction_vgh(self, x, y, z, basis): member in GTO
232 v,g,hess = self.eval_contraction_vgh(x, y, z, basis)