JOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:45:01 SAST 2025

MaxRAM=7.6G
MaxVMSize=0G
AveCPUFreq=0
AveDiskRead=15476252
AveDiskWrite=7670151731

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=RUNNING Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:34 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-12-02T06:47:27 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:45:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:46:02 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:46:33 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:47:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:47:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:48:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:48:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:49:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:49:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:50:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:50:33 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:51:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:51:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:52:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:52:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:53:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:53:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:54:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:54:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:55:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:55:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:56:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:56:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:57:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:57:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:58:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:58:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:59:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 07:59:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:00:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:00:33 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:01:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:01:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:02:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:02:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:03:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:03:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:04:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:04:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:05:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:05:32 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12
UCT HPC clusterJOB DETAILS FOR JOB 385589

captured Sun Nov 30 08:06:01 SAST 2025

01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=6679 Nice=0 Account=chemistry QOS=normal
   JobState=COMPLETED Reason=None Dependency=(null)
   Requeue=0 Restarts=0 BatchFlag=1 Reboot=0 ExitCode=0:0
   DerivedExitCode=0:0
   RunTime=1-00:57:51 TimeLimit=3-00:00:00 TimeMin=N/A
   SubmitTime=2025-11-29T06:47:26 EligibleTime=2025-11-29T06:47:26
   AccrueTime=2025-11-29T06:47:26
   StartTime=2025-11-29T06:47:27 EndTime=2025-11-30T07:45:18 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-11-29T06:47:26 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:3858329
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc102
   BatchHost=srvrochpc102
   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=srvrochpc102 CPU_IDs=0-11 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/Na-C4C1pyr-FSI/NaFSI-0.1/lammps_omp_array.sh
   WorkDir=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1
   StdErr=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Na-C4C1pyr-FSI/NaFSI-0.1/slurm-385589_5.out
   Power=
   TresPerTask=cpu:12