JOB DETAILS FOR JOB 329277

captured Fri Oct 31 09:51:01 SAST 2025

MaxRAM=6.3G
MaxVMSize=0G
AveCPUFreq=1K
AveDiskRead=14079001436+
AveDiskWrite=817220296250

JobId=329277 JobName=S3_S2
   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=23:35:14 TimeLimit=10-10:00:00 TimeMin=N/A
   SubmitTime=2025-10-30T10:15:46 EligibleTime=2025-10-30T10:15:46
   AccrueTime=2025-10-30T10:15:46
   StartTime=2025-10-30T10:15:47 EndTime=2025-11-09T20:15:47 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-30T10:15:47 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3491315
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc100
   BatchHost=srvrochpc100
   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=srvrochpc100 CPU_IDs=3,5-7,10-13,39-46 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-329277.out
   StdIn=/dev/null
   StdOut=/scratch/vhrdew002/slurm-329277.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 329277

captured Fri Oct 31 09:51:33 SAST 2025

JobId=329277 JobName=S3_S2
   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=23:35:17 TimeLimit=10-10:00:00 TimeMin=N/A
   SubmitTime=2025-10-30T10:15:46 EligibleTime=2025-10-30T10:15:46
   AccrueTime=2025-10-30T10:15:46
   StartTime=2025-10-30T10:15:47 EndTime=2025-10-31T09:51:04 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-30T10:15:47 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3491315
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc100
   BatchHost=srvrochpc100
   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=srvrochpc100 CPU_IDs=3,5-7,10-13,39-46 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-329277.out
   StdIn=/dev/null
   StdOut=/scratch/vhrdew002/slurm-329277.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 329277

captured Fri Oct 31 09:52:01 SAST 2025

JobId=329277 JobName=S3_S2
   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=23:35:17 TimeLimit=10-10:00:00 TimeMin=N/A
   SubmitTime=2025-10-30T10:15:46 EligibleTime=2025-10-30T10:15:46
   AccrueTime=2025-10-30T10:15:46
   StartTime=2025-10-30T10:15:47 EndTime=2025-10-31T09:51:04 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-30T10:15:47 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3491315
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc100
   BatchHost=srvrochpc100
   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=srvrochpc100 CPU_IDs=3,5-7,10-13,39-46 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-329277.out
   StdIn=/dev/null
   StdOut=/scratch/vhrdew002/slurm-329277.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 329277

captured Fri Oct 31 09:52:33 SAST 2025

JobId=329277 JobName=S3_S2
   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=23:35:17 TimeLimit=10-10:00:00 TimeMin=N/A
   SubmitTime=2025-10-30T10:15:46 EligibleTime=2025-10-30T10:15:46
   AccrueTime=2025-10-30T10:15:46
   StartTime=2025-10-30T10:15:47 EndTime=2025-10-31T09:51:04 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-30T10:15:47 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3491315
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc100
   BatchHost=srvrochpc100
   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=srvrochpc100 CPU_IDs=3,5-7,10-13,39-46 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-329277.out
   StdIn=/dev/null
   StdOut=/scratch/vhrdew002/slurm-329277.out
   Power=
   TresPerTask=cpu:16
   MailUser=dewald.vanheerden@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT