flake8 fixes
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3 changed files with 20 additions and 16 deletions
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@ -684,11 +684,11 @@ def eigsolve(
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Qi = Qi_func(theta)
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c2 = numpy.cos(2 * theta)
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s2 = numpy.sin(2 * theta)
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F = -0.5*s2 * (ZtAZ - DtAD) + c2 * symZtAD
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F = -0.5 * s2 * (ZtAZ - DtAD) + c2 * symZtAD
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trace_deriv = _rtrace_AtB(Qi, F)
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G = Qi @ F.conj().T @ Qi.conj().T
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H = -0.5*s2 * (ZtZ - DtD) + c2 * symZtD
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H = -0.5 * s2 * (ZtZ - DtD) + c2 * symZtD
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trace_deriv -= _rtrace_AtB(G, H)
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trace_deriv *= 2
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@ -696,12 +696,12 @@ def eigsolve(
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U_sZtD = U @ symZtD
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dE = 2.0 * (_rtrace_AtB(U, symZtAD) -
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_rtrace_AtB(ZtAZU, U_sZtD))
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dE = 2.0 * (_rtrace_AtB(U, symZtAD)
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- _rtrace_AtB(ZtAZU, U_sZtD))
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d2E = 2 * (_rtrace_AtB(U, DtAD) -
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_rtrace_AtB(ZtAZU, U @ (DtD - 4 * symZtD @ U_sZtD)) -
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4 * _rtrace_AtB(U, symZtAD @ U_sZtD))
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d2E = 2 * (_rtrace_AtB(U, DtAD)
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- _rtrace_AtB(ZtAZU, U @ (DtD - 4 * symZtD @ U_sZtD))
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- 4 * _rtrace_AtB(U, symZtAD @ U_sZtD))
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# Newton-Raphson to find a root of the first derivative:
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theta = -dE / d2E
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