Add test of out_alllog

Author: AsTonyshment

tests/10_others/05_Alllog_filename/INPUT

@@ -0,0 +1,21 @@
+INPUT_PARAMETERS 
+#Parameters (1.General)
+suffix               autotest
+calculation          md
+esolver_type         ksdft
+md_type              nve
+md_nstep             3
+symmetry             -1
+                 
+#Parameters (2.Iteration)
+ecutwfc              50
+scf_thr              1e-5
+scf_nmax             100
+#Parameters (3.Basis)
+basis_type           lcao
+                 
+#Parameters (4.Smearing)
+smearing_method      gauss
+smearing_sigma       0.002
+
+out_alllog           1

tests/10_others/05_Alllog_filename/KPT

@@ -0,0 +1,4 @@
+K_POINTS
+0
+Gamma
+3 2 2 0 0 0

tests/10_others/05_Alllog_filename/README

@@ -0,0 +1 @@
+Test if the log filenames are set correctly when out_alllog=1

tests/10_others/05_Alllog_filename/STRU

@@ -0,0 +1,21 @@
+ATOMIC_SPECIES
+Si 14.000 ../../PP_ORB/Si_ONCV_PBE_FR-1.1.upf
+
+NUMERICAL_ORBITAL
+../../PP_ORB/Si_gga_6au_100Ry_2s2p1d.orb
+
+LATTICE_CONSTANT
+10.2
+
+LATTICE_VECTORS
+0.0 0.5 0.5 		#Lattice vector 1
+0.5 0.0 0.5 		#Lattice vector 2
+0.5 0.5 0.0 		#Lattice vector 3
+
+ATOMIC_POSITIONS
+Cartesian 		#Cartesian(Unit is LATTICE_CONSTANT)
+Si 			#Name of element	
+0.0			#Magnetic for this element.
+2			#Number of atoms
+0.00 0.00 0.00 0 0 0	#x,y,z, move_x, move_y, move_z
+0.25 0.25 0.25 1 1 1

tests/10_others/05_Alllog_filename/result.ref

@@ -0,0 +1,4 @@
+etotref -211.1186500606459
+etotperatomref -105.5593250303
+log_filename_validation 1
+totaltimeref 1.55

tests/10_others/CASES_CPU.txt

@@ -1,3 +1,4 @@
 01_NP_KP_sp
 02_NP_KP_spd
 04_RDMFT_Si2
+05_Alllog_filename

tests/integrate/tools/catch_properties.sh

@@ -39,7 +39,12 @@ file=$1
 # the command will ignore lines starting with #
 calculation=`grep calculation INPUT | grep -v '^#' | awk '{print $2}' | sed s/[[:space:]]//g`
 
-running_path=`echo "OUT.autotest/running_$calculation"".log"`
+# running_path=`echo "OUT.autotest/running_$calculation"".log"`
+running_path=$(ls OUT.autotest/running_${calculation}*.log 2>/dev/null | head -1)
+if [ -z "$running_path" ]; then
+    echo "Error: No running log file found for calculation=$calculation in OUT.autotest/"
+    exit 1
+fi
 #echo $running_path
 
 natom=`grep -En '(^|[[:space:]])TOTAL ATOM NUMBER($|[[:space:]])' $running_path | tail -1 | awk '{print $6}'`
@@ -625,6 +630,47 @@ if ! test -z "$rdmft" && [[ $rdmft == 1 ]]; then
 	echo "" >>$1
 fi
 
+#--------------------------------------------
+# Check if out_alllog is set to 1
+# and verify running*.log filenames
+#--------------------------------------------
+out_alllog=$(get_input_key_value "out_alllog" "INPUT")
+if ! test -z "$out_alllog" && [ $out_alllog -eq 1 ]; then
+    calculation=$(get_input_key_value "calculation" "INPUT")
+
+    if [ -z "$calculation" ]; then
+        echo "Error: calculation parameter not found in INPUT"
+        exit 1
+    fi
+
+    # Find all running*.log files in OUT.autotest directory
+    log_files=$(ls OUT.autotest/running*.log 2>/dev/null)
+
+    if [ -z "$log_files" ]; then
+        echo "Error: No running*.log files found in OUT.autotest/"
+        exit 1
+    fi
+
+    # Check each log file name contains the calculation parameter
+    all_valid=true
+    for log_file in $log_files; do
+        filename=$(basename "$log_file")
+        if [[ ! "$filename" =~ running_${calculation}_ ]]; then
+            echo "Error: Invalid log filename $filename - should contain 'running_${calculation}_'"
+            all_valid=false
+        fi
+    done
+
+    if $all_valid; then
+        echo "All log filenames contain 'running_${calculation}_' - validation passed"
+        echo "log_filename_validation 1" >>$1
+    else
+        echo "Error: Some log filenames do not contain 'running_${calculation}_'"
+        echo "log_filename_validation 0" >>$1
+        exit 1
+    fi
+fi
+
 #--------------------------------------------
 # Check time information 
 #--------------------------------------------