update 031_PW_15_CF_CS

mohanchen · mohanchen · commit 91cb38b4efae · 2025-05-05T11:07:14.000+08:00
diff --git a/tests/01_PW/031_PW_15_CF_CS/INPUT b/tests/01_PW/031_PW_15_CF_CS/INPUT
@@ -12,7 +12,7 @@ smearing_method            gaussian
 smearing_sigma               0.02
 
 #Parameters (3.PW)
-ecutwfc             20
+ecutwfc             5
 scf_thr                 1e-9
 scf_nmax               100
 
diff --git a/tests/01_PW/031_PW_15_CF_CS/KPT b/tests/01_PW/031_PW_15_CF_CS/KPT
@@ -1,4 +1,4 @@
 K_POINTS
 0
 Gamma
-2 2 2  0 0 0
+2 1 1  0 0 0
diff --git a/tests/01_PW/031_PW_15_CF_CS/result.ref b/tests/01_PW/031_PW_15_CF_CS/result.ref
@@ -1,8 +1,8 @@
-etotref -4206.8778432376702767
-etotperatomref -2103.4389216188
-totalforceref 8.101896
-totalstressref 81776.176460
+etotref -3497.9130098229479700
+etotperatomref -1748.9565049115
+totalforceref 99.345678
+totalstressref 32344.551605
 pointgroupref C_1
 spacegroupref C_1
-nksibzref 8
-totaltimeref 6.35
+nksibzref 2
+totaltimeref 0.67
