deepmodeling · mohanchen · Nov 7, 2024 · Nov 7, 2024 · Nov 7, 2024
diff --git a/tests/integrate/212_NO_wfc_ienvelope/INPUT → tests/integrate/212_NO_wfc_get_wf/INPUT b/tests/integrate/212_NO_wfc_ienvelope/INPUT → tests/integrate/212_NO_wfc_get_wf/INPUT
diff --git a/tests/integrate/212_NO_wfc_ienvelope/KPT → tests/integrate/212_NO_wfc_get_wf/KPT b/tests/integrate/212_NO_wfc_ienvelope/KPT → tests/integrate/212_NO_wfc_get_wf/KPT
diff --git a/tests/integrate/212_NO_wfc_ienvelope/STRU → tests/integrate/212_NO_wfc_get_wf/STRU b/tests/integrate/212_NO_wfc_ienvelope/STRU → tests/integrate/212_NO_wfc_get_wf/STRU
diff --git a/...grate/212_NO_wfc_ienvelope/WFC_NAO_K1.txt → ...ntegrate/212_NO_wfc_get_wf/WFC_NAO_K1.txt b/...grate/212_NO_wfc_ienvelope/WFC_NAO_K1.txt → ...ntegrate/212_NO_wfc_get_wf/WFC_NAO_K1.txt
diff --git a/...grate/212_NO_wfc_ienvelope/WFC_NAO_K2.txt → ...ntegrate/212_NO_wfc_get_wf/WFC_NAO_K2.txt b/...grate/212_NO_wfc_ienvelope/WFC_NAO_K2.txt → ...ntegrate/212_NO_wfc_get_wf/WFC_NAO_K2.txt
diff --git a/tests/integrate/212_NO_wfc_ienvelope/jd → tests/integrate/212_NO_wfc_get_wf/jd b/tests/integrate/212_NO_wfc_ienvelope/jd → tests/integrate/212_NO_wfc_get_wf/jd
diff --git a/...integrate/212_NO_wfc_ienvelope/result.ref → tests/integrate/212_NO_wfc_get_wf/result.ref b/...integrate/212_NO_wfc_ienvelope/result.ref → tests/integrate/212_NO_wfc_get_wf/result.ref
diff --git a/tests/integrate/312_NO_GO_wfc_istate/INPUT → tests/integrate/312_NO_GO_wfc_get_pchg/INPUT b/tests/integrate/312_NO_GO_wfc_istate/INPUT → tests/integrate/312_NO_GO_wfc_get_pchg/INPUT
diff --git a/tests/integrate/312_NO_GO_wfc_ienvelope/KPT → tests/integrate/312_NO_GO_wfc_get_pchg/KPT b/tests/integrate/312_NO_GO_wfc_ienvelope/KPT → tests/integrate/312_NO_GO_wfc_get_pchg/KPT
diff --git a/tests/integrate/312_NO_GO_wfc_ienvelope/STRU → tests/integrate/312_NO_GO_wfc_get_pchg/STRU b/tests/integrate/312_NO_GO_wfc_ienvelope/STRU → tests/integrate/312_NO_GO_wfc_get_pchg/STRU
diff --git a/...12_NO_GO_wfc_ienvelope/WFC_NAO_GAMMA1.txt → ...312_NO_GO_wfc_get_pchg/WFC_NAO_GAMMA1.txt b/...12_NO_GO_wfc_ienvelope/WFC_NAO_GAMMA1.txt → ...312_NO_GO_wfc_get_pchg/WFC_NAO_GAMMA1.txt
diff --git a/tests/integrate/312_NO_GO_wfc_istate/jd → tests/integrate/312_NO_GO_wfc_get_pchg/jd b/tests/integrate/312_NO_GO_wfc_istate/jd → tests/integrate/312_NO_GO_wfc_get_pchg/jd
diff --git a/...integrate/312_NO_GO_wfc_istate/result.ref → ...tegrate/312_NO_GO_wfc_get_pchg/result.ref b/...integrate/312_NO_GO_wfc_istate/result.ref → ...tegrate/312_NO_GO_wfc_get_pchg/result.ref
diff --git a/...s/integrate/312_NO_GO_wfc_ienvelope/INPUT → tests/integrate/312_NO_GO_wfc_get_wf/INPUT b/...s/integrate/312_NO_GO_wfc_ienvelope/INPUT → tests/integrate/312_NO_GO_wfc_get_wf/INPUT
diff --git a/tests/integrate/312_NO_GO_wfc_istate/KPT → tests/integrate/312_NO_GO_wfc_get_wf/KPT b/tests/integrate/312_NO_GO_wfc_istate/KPT → tests/integrate/312_NO_GO_wfc_get_wf/KPT
diff --git a/tests/integrate/312_NO_GO_wfc_istate/STRU → tests/integrate/312_NO_GO_wfc_get_wf/STRU b/tests/integrate/312_NO_GO_wfc_istate/STRU → tests/integrate/312_NO_GO_wfc_get_wf/STRU
diff --git a/...e/312_NO_GO_wfc_istate/WFC_NAO_GAMMA1.txt → ...e/312_NO_GO_wfc_get_wf/WFC_NAO_GAMMA1.txt b/...e/312_NO_GO_wfc_istate/WFC_NAO_GAMMA1.txt → ...e/312_NO_GO_wfc_get_wf/WFC_NAO_GAMMA1.txt
diff --git a/tests/integrate/312_NO_GO_wfc_ienvelope/jd → tests/integrate/312_NO_GO_wfc_get_wf/jd b/tests/integrate/312_NO_GO_wfc_ienvelope/jd → tests/integrate/312_NO_GO_wfc_get_wf/jd
diff --git a/...egrate/312_NO_GO_wfc_ienvelope/result.ref → ...integrate/312_NO_GO_wfc_get_wf/result.ref b/...egrate/312_NO_GO_wfc_ienvelope/result.ref → ...integrate/312_NO_GO_wfc_get_wf/result.ref
diff --git a/tests/integrate/CASES_CPU.txt b/tests/integrate/CASES_CPU.txt
@@ -172,7 +172,7 @@
 211_NO_S2_elec_add
 211_NO_S2_nupdown0
 211_NO_S2_elec_minus
-212_NO_wfc_ienvelope
+212_NO_wfc_get_wf
 212_NO_wfc_out
 213_NO_mulliken
 214_NO_mulliken_nscf
@@ -224,8 +224,8 @@
 311_NO_GO_elec_minus
 311_NO_GO_S2_elec_minus
 312_NO_GO_wfc_file
-312_NO_GO_wfc_ienvelope
-312_NO_GO_wfc_istate
+312_NO_GO_wfc_get_wf
+312_NO_GO_wfc_get_pchg
 312_NO_GO_wfc_out
 313_NO_GO_mulliken
 314_NO_GO_dm_out