JOB DETAILS FOR JOB 215414

captured Mon Aug 4 05:48:33 SAST 2025

MaxRAM=12.5G
MaxVMSize=0G
AveCPUFreq=1K
AveDiskRead=2900366
AveDiskWrite=17235804606

JobId=215414 ArrayJobId=215413 ArrayTaskId=1 JobName=DCA
   UserId=01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6867 Nice=0 Account=chemistry QOS=normal
   JobState=RUNNING Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-23:35:45 TimeLimit=8-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-02T06:12:48 EligibleTime=2025-08-02T06:12:48
   AccrueTime=2025-08-02T06:12:48
   StartTime=2025-08-02T06:12:48 EndTime=2025-08-10T06:12:48 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-02T06:12:48 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:2646743
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc106
   BatchHost=srvrochpc106
   NumNodes=1 NumCPUs=12 NumTasks=1 CPUs/Task=12 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=12,mem=12G,node=1,billing=13
   AllocTRES=cpu=12,mem=12G,node=1,billing=13
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc106 CPU_IDs=12-23 Mem=12288 GRES=
   MinCPUsNode=12 MinMemoryNode=12G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01415816/MD/C4C1pyr-DCA/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/C4C1pyr-DCA
   StdErr=/scratch/01415816/MD/C4C1pyr-DCA/slurm-215413_1.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/C4C1pyr-DCA/slurm-215413_1.out
   Power=
   TresPerTask=cpu:12
   

UCT HPC clusterJOB DETAILS FOR JOB 215414

captured Mon Aug 4 05:49:01 SAST 2025

JobId=215414 ArrayJobId=215413 ArrayTaskId=1 JobName=DCA
   UserId=01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6867 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-23:35:50 TimeLimit=8-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-02T06:12:48 EligibleTime=2025-08-02T06:12:48
   AccrueTime=2025-08-02T06:12:48
   StartTime=2025-08-02T06:12:48 EndTime=2025-08-04T05:48:38 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-02T06:12:48 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:2646743
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc106
   BatchHost=srvrochpc106
   NumNodes=1 NumCPUs=12 NumTasks=1 CPUs/Task=12 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=12,mem=12G,node=1,billing=13
   AllocTRES=cpu=12,mem=12G,node=1,billing=13
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc106 CPU_IDs=12-23 Mem=12288 GRES=
   MinCPUsNode=12 MinMemoryNode=12G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01415816/MD/C4C1pyr-DCA/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/C4C1pyr-DCA
   StdErr=/scratch/01415816/MD/C4C1pyr-DCA/slurm-215413_1.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/C4C1pyr-DCA/slurm-215413_1.out
   Power=
   TresPerTask=cpu:12
   

UCT HPC clusterJOB DETAILS FOR JOB 215414

captured Mon Aug 4 05:49:33 SAST 2025

JobId=215414 ArrayJobId=215413 ArrayTaskId=1 JobName=DCA
   UserId=01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6867 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-23:35:50 TimeLimit=8-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-02T06:12:48 EligibleTime=2025-08-02T06:12:48
   AccrueTime=2025-08-02T06:12:48
   StartTime=2025-08-02T06:12:48 EndTime=2025-08-04T05:48:38 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-02T06:12:48 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:2646743
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc106
   BatchHost=srvrochpc106
   NumNodes=1 NumCPUs=12 NumTasks=1 CPUs/Task=12 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=12,mem=12G,node=1,billing=13
   AllocTRES=cpu=12,mem=12G,node=1,billing=13
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc106 CPU_IDs=12-23 Mem=12288 GRES=
   MinCPUsNode=12 MinMemoryNode=12G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01415816/MD/C4C1pyr-DCA/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/C4C1pyr-DCA
   StdErr=/scratch/01415816/MD/C4C1pyr-DCA/slurm-215413_1.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/C4C1pyr-DCA/slurm-215413_1.out
   Power=
   TresPerTask=cpu:12
   

UCT HPC clusterJOB DETAILS FOR JOB 215414

captured Mon Aug 4 05:50:01 SAST 2025

JobId=215414 ArrayJobId=215413 ArrayTaskId=1 JobName=DCA
   UserId=01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6867 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-23:35:50 TimeLimit=8-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-02T06:12:48 EligibleTime=2025-08-02T06:12:48
   AccrueTime=2025-08-02T06:12:48
   StartTime=2025-08-02T06:12:48 EndTime=2025-08-04T05:48:38 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-02T06:12:48 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:2646743
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc106
   BatchHost=srvrochpc106
   NumNodes=1 NumCPUs=12 NumTasks=1 CPUs/Task=12 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=12,mem=12G,node=1,billing=13
   AllocTRES=cpu=12,mem=12G,node=1,billing=13
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc106 CPU_IDs=12-23 Mem=12288 GRES=
   MinCPUsNode=12 MinMemoryNode=12G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01415816/MD/C4C1pyr-DCA/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/C4C1pyr-DCA
   StdErr=/scratch/01415816/MD/C4C1pyr-DCA/slurm-215413_1.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/C4C1pyr-DCA/slurm-215413_1.out
   Power=
   TresPerTask=cpu:12
   

UCT HPC clusterJOB DETAILS FOR JOB 215414

captured Mon Aug 4 05:50:33 SAST 2025

JobId=215414 ArrayJobId=215413 ArrayTaskId=1 JobName=DCA
   UserId=01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6867 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-23:35:50 TimeLimit=8-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-02T06:12:48 EligibleTime=2025-08-02T06:12:48
   AccrueTime=2025-08-02T06:12:48
   StartTime=2025-08-02T06:12:48 EndTime=2025-08-04T05:48:38 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-02T06:12:48 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:2646743
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc106
   BatchHost=srvrochpc106
   NumNodes=1 NumCPUs=12 NumTasks=1 CPUs/Task=12 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=12,mem=12G,node=1,billing=13
   AllocTRES=cpu=12,mem=12G,node=1,billing=13
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc106 CPU_IDs=12-23 Mem=12288 GRES=
   MinCPUsNode=12 MinMemoryNode=12G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01415816/MD/C4C1pyr-DCA/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/C4C1pyr-DCA
   StdErr=/scratch/01415816/MD/C4C1pyr-DCA/slurm-215413_1.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/C4C1pyr-DCA/slurm-215413_1.out
   Power=
   TresPerTask=cpu:12