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Commits on Apr 8, 2018
  1. Update reqs

    shyuep committed Apr 8, 2018
Commits on Apr 5, 2018
  1. Fix termination.

    shyuep committed Apr 5, 2018
  2. Minor cleanups.

    shyuep committed Apr 5, 2018
  3. Add a hard terminate using killall to address issues with undead

    shyuep committed Apr 5, 2018
    processes on Comet.
Commits on Mar 24, 2018
  1. Update reqs

    shyuep committed Mar 24, 2018
Commits on Mar 23, 2018
  1. Update reqs

    shyuep committed Mar 23, 2018
Commits on Mar 21, 2018
  1. Update reqs

    shyuep committed Mar 21, 2018
Commits on Mar 14, 2018
  1. Update reqs

    shyuep committed Mar 14, 2018
Commits on Mar 10, 2018
  1. Update dev docs

    shyuep committed Mar 10, 2018
  2. Merge pull request #73 from HanmeiTang/patch-1

    shyuep committed Mar 10, 2018
    Minor bug fix for `WalltimeHandler`
  3. Fix WalltimeHandler timezone

    HanmeiTang committed Mar 10, 2018
Commits on Feb 15, 2018
  1. Merge pull request #72 from czhengsci/feff_restart

    shyuep committed Feb 15, 2018
    add RESTART card to FEFF handler
  2. add RESTART card to FEFF handler

    czhengsci committed Feb 15, 2018
Commits on Feb 13, 2018
  1. Update reqs

    shyuep committed Feb 13, 2018
Commits on Jan 30, 2018
  1. Update reqs

    shyuep committed Jan 30, 2018
Commits on Jan 20, 2018
  1. Use PREC=Accurate on 2nd occurence of subspace matrix error. Fixes #63.

    shyuep committed Jan 20, 2018
Commits on Jan 19, 2018
  1. Update reqs

    shyuep committed Jan 19, 2018
Commits on Jan 13, 2018
  1. Update precondition job name (#70)

    shyamd authored and shyuep committed Jan 13, 2018
    * Change job name
    
    * remove erroneous print
Commits on Jan 10, 2018
  1. Add FEFF submodule (#69)

    czhengsci authored and shyuep committed Jan 10, 2018
    * add custodian job handlers interpreter for FEFF
    
    * bug fix
    
    * handler and FEFFjob debug
    
    * debug and add test file for handler
    
    * remove unneccessary files in test
    
    * debug
    
    * adjust handler algorithm
    
    * modified interperter based
    
    * bug fixin feff handlers
    
    * modified FeffModder
    
    * add postprocess to feff jobs
    
    * unittest add for feff job and handler
    
    * clean up import and documentation
    
    * update test files
    
    * code clean up
Commits on Jan 7, 2018
  1. Update reqs

    shyuep committed Jan 7, 2018
Commits on Dec 22, 2017
  1. Fix script.

    shyuep committed Dec 22, 2017
  2. Improve release sscript.

    shyuep committed Dec 22, 2017
  3. Update dev docs

    shyuep committed Dec 22, 2017
  4. v2017.12.23

    shyuep committed Dec 22, 2017
  5. Add fine-grained control of VaspErrorHandler via errors_subset_to_detect

    shyuep committed Dec 22, 2017
    option.
Commits on Dec 11, 2017
  1. Update reqs

    shyuep committed Dec 11, 2017
  2. Update reqs

    shyuep committed Dec 11, 2017
Commits on Dec 10, 2017
  1. Fixed timing check issue (#66)

    sivonxay authored and shyuep committed Dec 10, 2017
Commits on Dec 8, 2017
  1. Update the unconverged error handler for SCAN (#65)

    shyamd authored and shyuep committed Dec 8, 2017
    * test for SCAN in unconverted handler
    
    * Update unconverted error handler for SCAN
    
    * Fix typo
Commits on Dec 7, 2017
  1. Custodian job to optimize a structure using a metaGGA (#64)

    shyamd authored and shyuep committed Dec 7, 2017
    * metaGGA_opt
    
    * Fix some bugs from staging
    
    * Try returning a value
Commits on Dec 1, 2017
  1. Merge branch 'master' of github.com:materialsproject/custodian

    shyuep committed Dec 1, 2017
  2. Update reqs

    shyuep committed Dec 1, 2017
Commits on Nov 28, 2017
  1. Update reqs

    shyuep committed Nov 28, 2017
Commits on Nov 9, 2017
  1. Update dev docs

    shyuep committed Nov 9, 2017
  2. Fix update doc.

    shyuep committed Nov 9, 2017