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Fix non-LCAO elecstate energy test mock (deepmodeling#7736)
Co-authored-by: Stardust0831 <stardust0831@users.noreply.github.com>
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source/source_estate/test/elecstate_energy_test.cpp

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Original file line numberDiff line numberDiff line change
@@ -37,12 +37,10 @@ double ElecState::get_solvent_model_Acav()
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{
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return 0.5;
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}
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#ifdef __LCAO
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double ElecState::get_dftu_energy()
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{
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return 0.6;
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}
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#endif
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double ElecState::get_local_pp_energy()
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{
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return 0.7;
@@ -128,11 +126,7 @@ TEST_F(ElecStateEnergyTest, CalEnergiesHarrisDFTU)
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PARAM.input.dft_plus_u = 1;
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elecstate->cal_energies(1);
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// deband_harris + hatree + efiled + gatefield + edftu + escon
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#ifdef __LCAO
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EXPECT_DOUBLE_EQ(elecstate->f_en.etot_harris, 1.3);
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#else
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EXPECT_DOUBLE_EQ(elecstate->f_en.etot_harris, 0.7);
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#endif
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}
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TEST_F(ElecStateEnergyTest, CalEnergiesEtot)
@@ -158,11 +152,7 @@ TEST_F(ElecStateEnergyTest, CalEnergiesEtotDFTU)
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PARAM.input.dft_plus_u = 1;
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elecstate->cal_energies(2);
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// deband + hatree + efiled + gatefield + edftu + escon
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#ifdef __LCAO
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EXPECT_DOUBLE_EQ(elecstate->f_en.etot, 1.3);
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#else
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EXPECT_DOUBLE_EQ(elecstate->f_en.etot, 0.7);
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#endif
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}
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TEST_F(ElecStateEnergyTest, CalConverged)

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