JOB DETAILS FOR JOB 218875

captured Sat Aug 9 01:49:34 SAST 2025

MaxRAM=0.8G
MaxVMSize=0G
AveCPUFreq=24.55K
AveDiskRead=2862785
AveDiskWrite=1869151

JobId=218875 JobName=NEB_H2ads
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6708 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=1-15:59:52 TimeLimit=5-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-07T09:49:42 EligibleTime=2025-08-07T09:49:42
   AccrueTime=2025-08-07T09:49:42
   StartTime=2025-08-07T09:49:42 EndTime=2025-08-12T09:49:42 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-07T09:49:42 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:3277207
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc125
   BatchHost=srvrochpc125
   NumNodes=1 NumCPUs=40 NumTasks=40 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=40,mem=312.50G,node=1,billing=71
   AllocTRES=cpu=40,mem=312.50G,node=1,billing=71
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc125 CPU_IDs=0-19,24-43 Mem=320000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/job.pbs
   WorkDir=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03
   StdErr=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/slurm-218875.out
   StdIn=/dev/null
   StdOut=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/slurm-218875.out
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT
UCT HPC clusterJOB DETAILS FOR JOB 218875

captured Sat Aug 9 01:50:01 SAST 2025

JobId=218875 JobName=NEB_H2ads
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6708 Nice=0 Account=chemeng QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-16:00:04 TimeLimit=5-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-07T09:49:42 EligibleTime=2025-08-07T09:49:42
   AccrueTime=2025-08-07T09:49:42
   StartTime=2025-08-07T09:49:42 EndTime=2025-08-09T01:49:46 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-07T09:49:42 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:3277207
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc125
   BatchHost=srvrochpc125
   NumNodes=1 NumCPUs=40 NumTasks=40 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=40,mem=312.50G,node=1,billing=71
   AllocTRES=cpu=40,mem=312.50G,node=1,billing=71
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc125 CPU_IDs=0-19,24-43 Mem=320000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/job.pbs
   WorkDir=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03
   StdErr=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/slurm-218875.out
   StdIn=/dev/null
   StdOut=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/slurm-218875.out
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT
UCT HPC clusterJOB DETAILS FOR JOB 218875

captured Sat Aug 9 01:50:35 SAST 2025

JobId=218875 JobName=NEB_H2ads
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6708 Nice=0 Account=chemeng QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-16:00:04 TimeLimit=5-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-07T09:49:42 EligibleTime=2025-08-07T09:49:42
   AccrueTime=2025-08-07T09:49:42
   StartTime=2025-08-07T09:49:42 EndTime=2025-08-09T01:49:46 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-07T09:49:42 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:3277207
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc125
   BatchHost=srvrochpc125
   NumNodes=1 NumCPUs=40 NumTasks=40 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=40,mem=312.50G,node=1,billing=71
   AllocTRES=cpu=40,mem=312.50G,node=1,billing=71
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc125 CPU_IDs=0-19,24-43 Mem=320000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/job.pbs
   WorkDir=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03
   StdErr=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/slurm-218875.out
   StdIn=/dev/null
   StdOut=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/slurm-218875.out
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT
UCT HPC clusterJOB DETAILS FOR JOB 218875

captured Sat Aug 9 01:51:01 SAST 2025

JobId=218875 JobName=NEB_H2ads
   UserId=01445190(1221944711 Thobani Gambu) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6708 Nice=0 Account=chemeng QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=1 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-16:00:04 TimeLimit=5-00:00:00 TimeMin=N/A
   SubmitTime=2025-08-07T09:49:42 EligibleTime=2025-08-07T09:49:42
   AccrueTime=2025-08-07T09:49:42
   StartTime=2025-08-07T09:49:42 EndTime=2025-08-09T01:49:46 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-08-07T09:49:42 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001.uct.ac.za:3277207
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc125
   BatchHost=srvrochpc125
   NumNodes=1 NumCPUs=40 NumTasks=40 CPUs/Task=1 ReqB:S:C:T=0:0:*:*
   ReqTRES=cpu=40,mem=312.50G,node=1,billing=71
   AllocTRES=cpu=40,mem=312.50G,node=1,billing=71
   Socks/Node=* NtasksPerN:B:S:C=0:0:*:* CoreSpec=*
   JOB_GRES=(null)
     Nodes=srvrochpc125 CPU_IDs=0-19,24-43 Mem=320000 GRES=
   MinCPUsNode=1 MinMemoryCPU=8000M MinTmpDiskNode=0
   Features=(null) DelayBoot=00:00:00
   OverSubscribe=OK Contiguous=0 Licenses=(null) Network=(null)
   Command=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/job.pbs
   WorkDir=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03
   StdErr=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/slurm-218875.out
   StdIn=/dev/null
   StdOut=/scratch/01445190/2024/New_surface_cuts/Fe_adatom_on_TF/TFA_010b_p1x2/FTA_pFe_2OH_x2_pFe_OH_pCO2_rot0_diss/NEB_CO2_diss_mCO_H2ads/dimer_03/slurm-218875.out
   Power=
   MailUser=thobani.gambu@uct.ac.za MailType=INVALID_DEPEND,BEGIN,END,FAIL,REQUEUE,STAGE_OUT