Commits

History for

Commits on Sep 1, 2022

GPU ctests MD updated, complex script for matrix lab added
kartickr
committedSep 1, 2022
Complex ctests updated
kartickr
committedSep 1, 2022

Commits on Aug 28, 2022

Correct fix for Dirichlet Constraint and new ctest
gourabp7
committedAug 28, 2022

Commits on Jul 6, 2022

Modify LOW_RANK_JACINV to LOW_RANK_DIELECM
dsambit
committedJul 6, 2022

Commits on Jun 23, 2022

Add GPU LRJI test
dsambit
committedJun 23, 2022

Commits on May 30, 2022

modified GPUtests with new output
kartickr
committedMay 30, 2022

Commits on May 28, 2022

changed MD ctests input
kartickr
committedMay 28, 2022

Commits on May 23, 2022

GPU ctests modified
kartickr
committedMay 23, 2022

Commits on Apr 30, 2022

Final commit
kartickr
committedApr 30, 2022
ctest changes for GPU
kartickr
committedApr 30, 2022

Commits on Apr 29, 2022

Compilations success
kartickr
committedApr 29, 2022

Commits on Apr 4, 2022

Changes to MD GPU test and main.cc. No more elpa issue
kartickr
committedApr 4, 2022

Commits on Apr 2, 2022

Added GPUtest files
kartickr
committedApr 2, 2022

Commits on Feb 19, 2022

Modified complex GPU ctest output files.
kartickr
committedFeb 19, 2022

Commits on Feb 11, 2022

Max Energy error ~ E-7 Ha in GPU tests. testGPU replaced
kartickr
committedFeb 11, 2022

Commits on Jan 31, 2022

removing UCX warning messages from benchmark output
dsambit
committedJan 31, 2022

Commits on Nov 12, 2021

updated gpu ctest output files
dsambit
committedNov 12, 2021

Commits on Oct 19, 2021

Commits on Oct 18, 2021

Turn off elpa gpu kernel in gpu test for complex mode with k point parallelization, as it fails on Cori GPUs, but works on Summit- to be investigated
dsambit
committedOct 18, 2021

Commits on Oct 4, 2021

Added spin-polarized gpu complex test
dsambit
committedOct 4, 2021

Commits on Oct 3, 2021

Commits on Oct 2, 2021

Add gpu complex test
dsambit
committedOct 2, 2021

Commits on Oct 1, 2021

Merge branch 'publicGithubDevelop' of https://bitbucket.org/dftfedevelopers/dftfe into complexgpuporting
dsambit
committedOct 1, 2021

Commits on Sep 29, 2021

Add new gpu test and update gpu test outputfiles due to be pinned node fix
dsambit
committedSep 29, 2021

Commits on Sep 26, 2021

add new gpu test with kerker mixing and nodal density computation
dsambit
committedSep 26, 2021

Commits on Sep 17, 2021

Add a new gpu test
dsambit
committedSep 17, 2021

Commits on Aug 7, 2021

update gpu test output as ELPA with GPU in can now be used on NERSC Cori GPUs
dsambit
committedAug 7, 2021

Commits on May 2, 2021

Make RR GEP the default for CGS option and remove RR GEP as input parameter. Other minor cleanups
dsambit
committedMay 2, 2021

Commits on Apr 7, 2021

Updated gpu ctests due to stress calculation changes and tightening of nlp sparsity evaluation. Added gpu ctest for floating and smeared nuclear charges
dsambit
committedApr 7, 2021