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qs_ot_complex_ref_unittest.F File Reference

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Functions/Subroutines

program qs_ot_complex_ref_unittest
 Focused regressions for complex k-point OT derivatives.
subroutine test_density_tangent (mynode, nfail)
 Check the coupled finite-chart density tangent against a central finite difference.

Function/Subroutine Documentation

◆ qs_ot_complex_ref_unittest()

program qs_ot_complex_ref_unittest

Focused regressions for complex k-point OT derivatives.

Definition at line 11 of file qs_ot_complex_ref_unittest.F.

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◆ test_density_tangent()

subroutine qs_ot_complex_ref_unittest::test_density_tangent ( integer, intent(in) mynode,
integer, intent(inout) nfail )

Check the coupled finite-chart density tangent against a central finite difference.

Parameters
mynodeMPI rank
nfailaccumulated number of failures

Definition at line 105 of file qs_ot_complex_ref_unittest.F.

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