JOB DETAILS FOR JOB 322135

captured Thu Oct 30 14:14:41 SAST 2025

MaxRAM=5.2G
MaxVMSize=0G
AveCPUFreq=1K
AveDiskRead=53116381825+
AveDiskWrite=35657475227+

JobId=322135 JobName=S6_S1
   UserId=vhrdew002(465011007 Dewald Van Heerden) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6686 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=4-10:40:20 TimeLimit=10-10:00:00 TimeMin=N/A
   SubmitTime=2025-10-26T03:34:21 EligibleTime=2025-10-26T03:34:21
   AccrueTime=2025-10-26T03:34:21
   StartTime=2025-10-26T03:34:21 EndTime=2025-11-05T13:34:21 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-26T03:34:21 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:1059099
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=16 NumTasks=1 CPUs/Task=16 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=16,mem=125G,node=1,billing=28
   AllocTRES=cpu=16,mem=125G,node=1,billing=28
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=0,12,15,17-19,21-30 Mem=128000 GRES=
   MinCPUsNode=16 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/vhrdew002/gaussian16.sh
   WorkDir=/scratch/vhrdew002
   StdErr=/scratch/vhrdew002/slurm-322135.out
   StdIn=/dev/null
   StdOut=/scratch/vhrdew002/slurm-322135.out
   Power=
   TresPerTask=cpu:16
   MailUser=dewald.vanheerden@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT
UCT HPC clusterJOB DETAILS FOR JOB 322135

captured Thu Oct 30 14:15:01 SAST 2025

JobId=322135 JobName=S6_S1
   UserId=vhrdew002(465011007 Dewald Van Heerden) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6686 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=4-10:40:32 TimeLimit=10-10:00:00 TimeMin=N/A
   SubmitTime=2025-10-26T03:34:21 EligibleTime=2025-10-26T03:34:21
   AccrueTime=2025-10-26T03:34:21
   StartTime=2025-10-26T03:34:21 EndTime=2025-10-30T14:14:53 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-26T03:34:21 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:1059099
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=16 NumTasks=1 CPUs/Task=16 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=16,mem=125G,node=1,billing=28
   AllocTRES=cpu=16,mem=125G,node=1,billing=28
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=0,12,15,17-19,21-30 Mem=128000 GRES=
   MinCPUsNode=16 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/vhrdew002/gaussian16.sh
   WorkDir=/scratch/vhrdew002
   StdErr=/scratch/vhrdew002/slurm-322135.out
   StdIn=/dev/null
   StdOut=/scratch/vhrdew002/slurm-322135.out
   Power=
   TresPerTask=cpu:16
   MailUser=dewald.vanheerden@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT
UCT HPC clusterJOB DETAILS FOR JOB 322135

captured Thu Oct 30 14:15:41 SAST 2025

JobId=322135 JobName=S6_S1
   UserId=vhrdew002(465011007 Dewald Van Heerden) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6686 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=4-10:40:32 TimeLimit=10-10:00:00 TimeMin=N/A
   SubmitTime=2025-10-26T03:34:21 EligibleTime=2025-10-26T03:34:21
   AccrueTime=2025-10-26T03:34:21
   StartTime=2025-10-26T03:34:21 EndTime=2025-10-30T14:14:53 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-26T03:34:21 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:1059099
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=16 NumTasks=1 CPUs/Task=16 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=16,mem=125G,node=1,billing=28
   AllocTRES=cpu=16,mem=125G,node=1,billing=28
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=0,12,15,17-19,21-30 Mem=128000 GRES=
   MinCPUsNode=16 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/vhrdew002/gaussian16.sh
   WorkDir=/scratch/vhrdew002
   StdErr=/scratch/vhrdew002/slurm-322135.out
   StdIn=/dev/null
   StdOut=/scratch/vhrdew002/slurm-322135.out
   Power=
   TresPerTask=cpu:16
   MailUser=dewald.vanheerden@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT
UCT HPC clusterJOB DETAILS FOR JOB 322135

captured Thu Oct 30 14:16:01 SAST 2025

JobId=322135 JobName=S6_S1
   UserId=vhrdew002(465011007 Dewald Van Heerden) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6686 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=4-10:40:32 TimeLimit=10-10:00:00 TimeMin=N/A
   SubmitTime=2025-10-26T03:34:21 EligibleTime=2025-10-26T03:34:21
   AccrueTime=2025-10-26T03:34:21
   StartTime=2025-10-26T03:34:21 EndTime=2025-10-30T14:14:53 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-26T03:34:21 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:1059099
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   NumNodes=1 NumCPUs=16 NumTasks=1 CPUs/Task=16 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=16,mem=125G,node=1,billing=28
   AllocTRES=cpu=16,mem=125G,node=1,billing=28
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc102 CPU_IDs=0,12,15,17-19,21-30 Mem=128000 GRES=
   MinCPUsNode=16 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/vhrdew002/gaussian16.sh
   WorkDir=/scratch/vhrdew002
   StdErr=/scratch/vhrdew002/slurm-322135.out
   StdIn=/dev/null
   StdOut=/scratch/vhrdew002/slurm-322135.out
   Power=
   TresPerTask=cpu:16
   MailUser=dewald.vanheerden@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT