| MaxRAM=3.2G | 
| JobId=323729 JobName=LAMMPS
   UserId=01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7052 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=23:26:02 TimeLimit=4-00:00:00 TimeMin=N/A
   SubmitTime=2025-10-27T17:21:22 EligibleTime=2025-10-27T17:21:22
   AccrueTime=2025-10-27T17:21:22
   StartTime=2025-10-28T05:47:59 EndTime=2025-11-01T05:47:59 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-28T05:47:59 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:2282279
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc100
   BatchHost=srvrochpc100
   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=srvrochpc100 CPU_IDs=0-7,10-13 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/Unfunctionalized/run_A2/Na_03/lammps_omp.sh
   WorkDir=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03
   StdErr=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03/slurm-323729.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03/slurm-323729.out
   Power=
   TresPerTask=cpu:12
   
 | 
| JobId=323729 JobName=LAMMPS
   UserId=01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7052 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=23:26:56 TimeLimit=4-00:00:00 TimeMin=N/A
   SubmitTime=2025-10-27T17:21:22 EligibleTime=2025-10-27T17:21:22
   AccrueTime=2025-10-27T17:21:22
   StartTime=2025-10-28T05:47:59 EndTime=2025-10-29T05:14:55 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-28T05:47:59 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:2282279
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc100
   BatchHost=srvrochpc100
   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=srvrochpc100 CPU_IDs=0-7,10-13 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/Unfunctionalized/run_A2/Na_03/lammps_omp.sh
   WorkDir=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03
   StdErr=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03/slurm-323729.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03/slurm-323729.out
   Power=
   TresPerTask=cpu:12
   
 | 
| JobId=323729 JobName=LAMMPS
   UserId=01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7052 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=23:26:56 TimeLimit=4-00:00:00 TimeMin=N/A
   SubmitTime=2025-10-27T17:21:22 EligibleTime=2025-10-27T17:21:22
   AccrueTime=2025-10-27T17:21:22
   StartTime=2025-10-28T05:47:59 EndTime=2025-10-29T05:14:55 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-28T05:47:59 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:2282279
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc100
   BatchHost=srvrochpc100
   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=srvrochpc100 CPU_IDs=0-7,10-13 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/Unfunctionalized/run_A2/Na_03/lammps_omp.sh
   WorkDir=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03
   StdErr=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03/slurm-323729.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03/slurm-323729.out
   Power=
   TresPerTask=cpu:12
   
 | 
| JobId=323729 JobName=LAMMPS
   UserId=01415816(1767272628 Gerhard Venter) GroupId=eresearch_hpc_users(1221947160) MCS_label=N/A
   Priority=7052 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=23:26:56 TimeLimit=4-00:00:00 TimeMin=N/A
   SubmitTime=2025-10-27T17:21:22 EligibleTime=2025-10-27T17:21:22
   AccrueTime=2025-10-27T17:21:22
   StartTime=2025-10-28T05:47:59 EndTime=2025-10-29T05:14:55 Deadline=N/A
   SuspendTime=None SecsPreSuspend=0 LastSchedEval=2025-10-28T05:47:59 Scheduler=Main
   Partition=ada AllocNode:Sid=srvrochpc001:2282279
   ReqNodeList=(null) ExcNodeList=(null)
   NodeList=srvrochpc100
   BatchHost=srvrochpc100
   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=srvrochpc100 CPU_IDs=0-7,10-13 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/Unfunctionalized/run_A2/Na_03/lammps_omp.sh
   WorkDir=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03
   StdErr=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03/slurm-323729.out
   StdIn=/dev/null
   StdOut=/scratch/01415816/MD/Unfunctionalized/run_A2/Na_03/slurm-323729.out
   Power=
   TresPerTask=cpu:12
   
 |