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Commit 2cd46073 authored by Henning Glawe's avatar Henning Glawe
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remove LDA_X from gaup

parent a0b60aa8
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......@@ -663,6 +663,9 @@ EXCHANGE_GRADIENT_CORRECTION = [
'XC_functional_name': "GGA_X_PBE",
'exx_compute_weight': lambda exx: 0.0 if (abs(exx) > 0.01) else 1.0
}],
'xc_terms_subtract': [{
'XC_functional_name': 'LDA_X',
}],
'xc_section_method': {
'x_qe_xc_igcx_name': "gaup",
'x_qe_xc_igcx_comment': "Gau-PBE hybrid exchange",
......
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