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Default is to read all determinants through cutoff set to 1e-20

This commit is contained in:
anbenali 2019-01-21 14:38:49 -06:00
parent 8025d469c3
commit 0901ccf697
2 changed files with 2 additions and 2 deletions
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2
tests/converter/test_aldet1/gold.wfnoj.xml
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@ -79,7 +79,7 @@
</coefficient> </coefficient>
</sposet> </sposet>
<multideterminant optimize="no" spo_up="spo-up" spo_dn="spo-dn"> <multideterminant optimize="no" spo_up="spo-up" spo_dn="spo-dn">
<detlist size="1" type="DETS" nca="0" ncb="0" nea="1" neb="1" nstates="1" cutoff="0.01"> <detlist size="1" type="DETS" nca="0" ncb="0" nea="1" neb="1" nstates="1" cutoff="1e-20">
<ci id="CIcoeff_0" coeff="1" qc_coeff="1" alpha="1" beta="1"/> <ci id="CIcoeff_0" coeff="1" qc_coeff="1" alpha="1" beta="1"/>
</detlist> </detlist>
</multideterminant> </multideterminant>

2
tests/converter/test_aldet5/gold.wfnoj.xml
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@ -79,7 +79,7 @@
</coefficient> </coefficient>
</sposet> </sposet>
<multideterminant optimize="yes" spo_up="spo-up" spo_dn="spo-dn"> <multideterminant optimize="yes" spo_up="spo-up" spo_dn="spo-dn">
<detlist size="4" type="DETS" nca="0" ncb="0" nea="1" neb="1" nstates="5" cutoff="0.01"> <detlist size="4" type="DETS" nca="0" ncb="0" nea="1" neb="1" nstates="5" cutoff="1e-20">
<ci id="CIcoeff_0" coeff="0.96098" qc_coeff="0.96098" alpha="10000" beta="10000"/> <ci id="CIcoeff_0" coeff="0.96098" qc_coeff="0.96098" alpha="10000" beta="10000"/>
<ci id="CIcoeff_1" coeff="0.178789" qc_coeff="0.178789" alpha="10000" beta="00100"/> <ci id="CIcoeff_1" coeff="0.178789" qc_coeff="0.178789" alpha="10000" beta="00100"/>
<ci id="CIcoeff_2" coeff="0.178789" qc_coeff="0.178789" alpha="00100" beta="10000"/> <ci id="CIcoeff_2" coeff="0.178789" qc_coeff="0.178789" alpha="00100" beta="10000"/>