UCT HPC cluster

JOB DETAILS FOR JOB 298368

captured Mon Oct 6 06:14:01 SAST 2025

MaxRAM=9.4G
MaxVMSize=0G
AveCPUFreq=11K
AveDiskRead=1294203894
AveDiskWrite=51082068

JobId=298368 JobName=MD_TF_C2H6
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6675 Nice=0 Account=chemeng QOS=normal
   JobState=RUNNING Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=2-19:41:16 TimeLimit=7-02:00:00 TimeMin=N/A
   SubmitTime=2025-10-03T10:32:45 EligibleTime=2025-10-03T10:32:45
   AccrueTime=2025-10-03T10:32:45
   StartTime=2025-10-03T10:32:45 EndTime=2025-10-10T12:32:45 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-03T10:32:45 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:445026
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=2 NumTasks=2 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=9G,node=1,billing=2
   AllocTRES=cpu=2,mem=9G,node=1,billing=2
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=18,42 Mem=9216 GRES=
   MinCPUsNode=2 MinMemoryNode=9G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/GA.pbs
   WorkDir=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x
   StdErr=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_error.log
   StdIn=/dev/null
   StdOut=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_output.log
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 298368

captured Mon Oct 6 06:14:35 SAST 2025

JobId=298368 JobName=MD_TF_C2H6
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6675 Nice=0 Account=chemeng QOS=normal
   JobState=OUT_OF_MEMORY Reason=OutOfMemory Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:125
   DerivedExitCode=0:0
   RunTime=2-19:41:50 TimeLimit=7-02:00:00 TimeMin=N/A
   SubmitTime=2025-10-03T10:32:45 EligibleTime=2025-10-03T10:32:45
   AccrueTime=2025-10-03T10:32:45
   StartTime=2025-10-03T10:32:45 EndTime=2025-10-06T06:14:35 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-03T10:32:45 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:445026
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=2 NumTasks=2 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=9G,node=1,billing=2
   AllocTRES=cpu=2,mem=9G,node=1,billing=2
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=18,42 Mem=9216 GRES=
   MinCPUsNode=2 MinMemoryNode=9G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/GA.pbs
   WorkDir=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x
   StdErr=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_error.log
   StdIn=/dev/null
   StdOut=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_output.log
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 298368

captured Mon Oct 6 06:15:01 SAST 2025

JobId=298368 JobName=MD_TF_C2H6
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6675 Nice=0 Account=chemeng QOS=normal
   JobState=OUT_OF_MEMORY Reason=OutOfMemory Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:125
   DerivedExitCode=0:0
   RunTime=2-19:41:50 TimeLimit=7-02:00:00 TimeMin=N/A
   SubmitTime=2025-10-03T10:32:45 EligibleTime=2025-10-03T10:32:45
   AccrueTime=2025-10-03T10:32:45
   StartTime=2025-10-03T10:32:45 EndTime=2025-10-06T06:14:35 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-03T10:32:45 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:445026
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=2 NumTasks=2 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=9G,node=1,billing=2
   AllocTRES=cpu=2,mem=9G,node=1,billing=2
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=18,42 Mem=9216 GRES=
   MinCPUsNode=2 MinMemoryNode=9G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/GA.pbs
   WorkDir=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x
   StdErr=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_error.log
   StdIn=/dev/null
   StdOut=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_output.log
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 298368

captured Mon Oct 6 06:15:37 SAST 2025

JobId=298368 JobName=MD_TF_C2H6
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6675 Nice=0 Account=chemeng QOS=normal
   JobState=OUT_OF_MEMORY Reason=OutOfMemory Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:125
   DerivedExitCode=0:0
   RunTime=2-19:41:50 TimeLimit=7-02:00:00 TimeMin=N/A
   SubmitTime=2025-10-03T10:32:45 EligibleTime=2025-10-03T10:32:45
   AccrueTime=2025-10-03T10:32:45
   StartTime=2025-10-03T10:32:45 EndTime=2025-10-06T06:14:35 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-03T10:32:45 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:445026
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=2 NumTasks=2 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=9G,node=1,billing=2
   AllocTRES=cpu=2,mem=9G,node=1,billing=2
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=18,42 Mem=9216 GRES=
   MinCPUsNode=2 MinMemoryNode=9G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/GA.pbs
   WorkDir=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x
   StdErr=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_error.log
   StdIn=/dev/null
   StdOut=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_output.log
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 298368

captured Mon Oct 6 06:16:02 SAST 2025

JobId=298368 JobName=MD_TF_C2H6
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6675 Nice=0 Account=chemeng QOS=normal
   JobState=OUT_OF_MEMORY Reason=OutOfMemory Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:125
   DerivedExitCode=0:0
   RunTime=2-19:41:50 TimeLimit=7-02:00:00 TimeMin=N/A
   SubmitTime=2025-10-03T10:32:45 EligibleTime=2025-10-03T10:32:45
   AccrueTime=2025-10-03T10:32:45
   StartTime=2025-10-03T10:32:45 EndTime=2025-10-06T06:14:35 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-03T10:32:45 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:445026
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=2 NumTasks=2 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=9G,node=1,billing=2
   AllocTRES=cpu=2,mem=9G,node=1,billing=2
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=18,42 Mem=9216 GRES=
   MinCPUsNode=2 MinMemoryNode=9G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/GA.pbs
   WorkDir=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x
   StdErr=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_error.log
   StdIn=/dev/null
   StdOut=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_output.log
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 298368

captured Mon Oct 6 06:16:35 SAST 2025

JobId=298368 JobName=MD_TF_C2H6
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6675 Nice=0 Account=chemeng QOS=normal
   JobState=OUT_OF_MEMORY Reason=OutOfMemory Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:125
   DerivedExitCode=0:0
   RunTime=2-19:41:50 TimeLimit=7-02:00:00 TimeMin=N/A
   SubmitTime=2025-10-03T10:32:45 EligibleTime=2025-10-03T10:32:45
   AccrueTime=2025-10-03T10:32:45
   StartTime=2025-10-03T10:32:45 EndTime=2025-10-06T06:14:35 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-03T10:32:45 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:445026
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=2 NumTasks=2 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=9G,node=1,billing=2
   AllocTRES=cpu=2,mem=9G,node=1,billing=2
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=18,42 Mem=9216 GRES=
   MinCPUsNode=2 MinMemoryNode=9G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/GA.pbs
   WorkDir=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x
   StdErr=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_error.log
   StdIn=/dev/null
   StdOut=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_output.log
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT

UCT HPC clusterJOB DETAILS FOR JOB 298368

captured Mon Oct 6 06:17:01 SAST 2025

JobId=298368 JobName=MD_TF_C2H6
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6675 Nice=0 Account=chemeng QOS=normal
   JobState=OUT_OF_MEMORY Reason=OutOfMemory Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:125
   DerivedExitCode=0:0
   RunTime=2-19:41:50 TimeLimit=7-02:00:00 TimeMin=N/A
   SubmitTime=2025-10-03T10:32:45 EligibleTime=2025-10-03T10:32:45
   AccrueTime=2025-10-03T10:32:45
   StartTime=2025-10-03T10:32:45 EndTime=2025-10-06T06:14:35 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-03T10:32:45 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:445026
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=2 NumTasks=2 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=2,mem=9G,node=1,billing=2
   AllocTRES=cpu=2,mem=9G,node=1,billing=2
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=18,42 Mem=9216 GRES=
   MinCPUsNode=2 MinMemoryNode=9G MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/GA.pbs
   WorkDir=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x
   StdErr=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_error.log
   StdIn=/dev/null
   StdOut=/scratch/01445190/2025/MD_TF_synthesis/MD_nvt_400K_CuAg2_NO3_4_p3x3_originalbox_2x/job_output.log
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT