/dports/science/py-pyscf/pyscf-2.0.1/pyscf/dft/ |
H A D | dks.py | 158 _eigh = dhf.RDHF._eigh variable in RDKS
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/dports/science/py-chainer/chainer-7.8.0/chainer/functions/normalization/ |
H A D | decorrelated_batch_normalization.py | 14 def _eigh(a, xp): function 102 self.eigvals, self.eigvectors = _eigh(cov, xp)
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/dports/science/py-pyscf/pyscf-2.0.1/pyscf/scf/ |
H A D | ghf_symm.py | 149 return self._eigh(h, s) 159 e, c = self._eigh(h[ir], s[ir])
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H A D | uhf_symm.py | 327 return self._eigh(h, s) 336 e, c = self._eigh(ha[ir], s[ir]) 349 e, c = self._eigh(hb[ir], s[ir])
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H A D | atom_hf.py | 116 e, c = self._eigh(f_l, s_l)
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H A D | dhf.py | 675 def _eigh(self, h, s): member in HF1e 679 return DHF._eigh(self, h, s) 691 def _eigh(self, h, s): member in RDHF
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H A D | hf_symm.py | 215 mo_energy, u = mf._eigh(fock_ir, s_ir) 302 return mf._eigh(h, s) 311 e, c = mf._eigh(h[ir], s[ir])
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H A D | uhf.py | 775 e_a, c_a = self._eigh(fock[0], s) 776 e_b, c_b = self._eigh(fock[1], s)
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H A D | addons.py | 513 mf._eigh = eigh 525 mf._eigh = eigh
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H A D | rohf.py | 380 e, c = self._eigh(fock, s)
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H A D | hf.py | 1487 def _eigh(self, h, s): member in SCF 1496 return self._eigh(h, s)
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/dports/science/py-pyscf/pyscf-2.0.1/pyscf/x2c/ |
H A D | x2c.py | 362 def _eigh(self, h, s): member in X2C_UHF 490 def _eigh(self, h, s): member in X2C_RHF 521 def _eigh(self, h, s): member in X2C_RKS
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/dports/science/py-pyscf/pyscf-2.0.1/pyscf/pbc/scf/ |
H A D | khf.py | 681 e, c = self._eigh(h_kpts[k], s_kpts[k])
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/dports/math/py-jax/jax-0.2.9/jax/experimental/jax2tf/ |
H A D | jax2tf.py | 2116 def _eigh(operand: TfVal, lower: bool): function 2129 tf_impl[lax_linalg.eigh_p] = _eigh
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/dports/math/py-algopy/algopy-0.5.7/algopy/utpm/ |
H A D | algorithms.py | 1928 def _eigh(cls, L_data, Q_data, A_data, epsilon = 1e-8, full_output = False): member in RawAlgorithmsMixIn
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H A D | utpm.py | 2733 UTPM._eigh( l.data, Q.data, A.data, epsilon = epsilon)
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