CCMST Weekly News, July 9, 2010

Center for Computational Molecular Science and Technology


1. Announcements
2. Statistics3. Tip of the WeekANNOUNCEMENTSSummer Lecture Series in Electronic Structure Theory

Throughout the summer, a series of lectures in electronic structure theory will be presented at the advanced undergraduate / beginning graduate level. Lectures will be held Tuesdays and Thursdays in MSE 4202A
from 2-3PM. The summer students, the new theory/computational graduate students, and anyone else who is interested are cordially invited to attend.

The series will continue next week with the following schedule:July 13: Density Functional Theory (Parrish)
July 15: Many-body Perturbation Theory (Marshall)

The complete schedule of the lectures can be found at http://vergil.chemistry.gatech.edu/opp/sched.html.

STATISTICS

FGATE

Uptime: 323 days/home directory usage: 66% (2.0TB available)/backups directory usage: 80%

LSF usage for Week 26 (6/28-7/4) (times are in minutes)GroupJobsTotal CPUAvg CPUAvg WaitAvg Trnr.Bredas6519743110%303712744538Hernandez276808204%29329323Sherrill109880135%80716362454Total45036626519%8145981448
Note: percentages refer to the total CPU time available for the period.

Most productive user of the Week: pwinget 122963.

LSF usage for Month of June (times are in minutes)GroupJobsTotal CPUAvg CPUAvg WaitAvg Trnr.Bredas264499788112%377283930Hernandez63282007710%12982731629Sherrill5133464804%67518532551Other100%001Total3790216443826%5714941266
Note: percentages refer to the total CPU time available for the period.

EGATE

Uptime: 222 days/theoryfs/common directory usage: 35% (431GB available)/theoryfs/ccmst directory usage: 80% (175GB available)


LSF usage for Week 26 (6/28-7/4) (times are in minutes)GroupJobsTotal CPUAvg CPUAvg WaitAvg Trnr.Hernandez2121294199%610136767Sherrill90436496224%404205610Other33438970326%1167671241Total145088408458%610163778
Note: percentages refer to the total CPU time available for the period.

Most productive user of the Week: rnear 365743.


LSF usage for Month of June (times are in minutes)GroupJobsTotal CPUAvg CPUAvg WaitAvg Trnr.Bredas6051210%85086Hernandez379140145822%3698593792Sherrill442667428710%15243231Other2452887884%1179211205Total5110236965537%46443540
Note: percentages refer to the total CPU time available for the period.

TIP OF THE WEEK
By Michael S. Marshall

Some more utility scripts for fgate

/share/apps/bin/killal.py
This script can be used to kill stale processes left by jobs run amok. This script is similar to the cleanup script ...

Read More