Fix: change reference of Gamma-only case and SOC case

dyzheng · dyzheng · commit d02d5e46aba3 · 2024-11-05T15:05:56.000Z
diff --git a/tests/deepks/602_NO_deepks_d_H2O_md_lda2pbe/result.ref b/tests/deepks/602_NO_deepks_d_H2O_md_lda2pbe/result.ref
@@ -1,9 +1,9 @@
-etotref -465.998623450138
-etotperatomref -155.3328744834
-totalforceref 5.535421
-totalstressref 1.520071
+etotref -465.9986234579140
+etotperatomref -155.3328744860
+totalforceref 5.535106
+totalstressref 1.520003
 totaldes 2.163703
-deepks_e_dm -57.88571808911911
-deepks_f_label 19.095622987658235
-deepks_s_label 19.250436793943024
-totaltimeref 19.73
+deepks_e_dm -57.885718058035934
+deepks_f_label 19.095598453044364
+deepks_s_label 19.250415261605152
+totaltimeref 12.68
diff --git a/tests/integrate/260_NO_DJ_PK_PU_SO/result.ref b/tests/integrate/260_NO_DJ_PK_PU_SO/result.ref
@@ -1,5 +1,5 @@
-etotref -6789.2817503491551179
+etotref -6789.2817503491569369
 etotperatomref -3394.6408751746
-totalforceref 11.319866
-totalstressref 4893.060045
-totaltimeref 5.40
+totalforceref 11.329526
+totalstressref 4894.902744
+totaltimeref 4.70
diff --git a/tests/integrate/308_NO_GO_CF_RE/result.ref b/tests/integrate/308_NO_GO_CF_RE/result.ref
@@ -1,8 +1,8 @@
-etotref -195.5641752854862148
+etotref -195.5641752854540130
 etotperatomref -97.7820876427
-totalforceref 15.805668
+totalforceref 15.805546
 totalstressref 1875.626439
 pointgroupref C_2v
 spacegroupref D_2h
 nksibzref 1
-totaltimeref 3.56
+totaltimeref 0.69
diff --git a/tests/integrate/320_NO_GO_MD_NVT/result.ref b/tests/integrate/320_NO_GO_MD_NVT/result.ref
@@ -1,5 +1,5 @@
-etotref -196.5943381700034
-etotperatomref -98.2971690850
-totalforceref 4.029842
-totalstressref 1484.529510
-totaltimeref +1.7855
+etotref -196.5943379249982
+etotperatomref -98.2971689625
+totalforceref 4.029872
+totalstressref 1484.529901
+totaltimeref 1.56
