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cp2k
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dbcsr
DBCSR: Distributed Block Compressed Sparse Row matrix library
https://cp2k.github.io/dbcsr/
GNU General Public License v2.0
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[pre-commit.ci] pre-commit autoupdate
#689
pre-commit-ci[bot]
closed
1 year ago
1
Uniform macro MPI_F08 with CP2K
#688
alazzaro
closed
1 year ago
0
Enable MPI_F08
#687
alazzaro
closed
1 year ago
0
Test MPI_F08
#686
alazzaro
closed
1 year ago
1
[pre-commit.ci] pre-commit autoupdate
#685
pre-commit-ci[bot]
closed
1 year ago
1
acc: Always set active device before accessing a GPU
#684
oschuett
closed
1 year ago
5
Evaluate USE_ACCEL=opencl
#683
hfp
opened
1 year ago
0
Enable chunks and checkpoint files also in serial
#682
mkrack
closed
1 year ago
0
ocl: updated Makefile
#681
hfp
closed
1 year ago
0
Extend database of autotuned and predicted A100 kernels
#680
mkrack
closed
1 year ago
8
[pre-commit.ci] pre-commit autoupdate
#679
pre-commit-ci[bot]
closed
1 year ago
1
Add support for the new mpi_f08 module
#678
fstein93
closed
1 year ago
4
Wrap the MPI handles
#677
fstein93
closed
1 year ago
5
[pre-commit.ci] pre-commit autoupdate
#676
pre-commit-ci[bot]
closed
1 year ago
1
[pre-commit.ci] pre-commit autoupdate
#675
pre-commit-ci[bot]
closed
1 year ago
1
[pre-commit.ci] pre-commit autoupdate
#674
pre-commit-ci[bot]
closed
1 year ago
1
Bugfixes for building DBCSR on macOS, with CUDA, latest-gcc
#673
dev-zero
closed
1 year ago
0
ocl: ensure compatibility with LIBXSMM 2.0
#672
hfp
closed
1 year ago
4
Add the posibility to build dbcsr shared library
#671
mtaillefumier
closed
1 year ago
5
ocl: added README.md for the tuned parameters
#670
hfp
closed
1 year ago
0
ocl: added README.md for tuned parameters
#669
hfp
closed
1 year ago
0
cuda tests are broken
#668
hfp
closed
1 year ago
1
ocl: fixed backend initialization
#667
hfp
closed
1 year ago
0
ocl: updated/added tuned parameters
#666
hfp
closed
1 year ago
0
ocl: various fixes for auto-tuning script
#665
hfp
closed
1 year ago
0
ocl: fixed exit-condition of tuning script
#664
hfp
closed
1 year ago
0
ocl: streamlined warning messages
#663
hfp
closed
1 year ago
0
ocl: fixed condition when flex-matching tuned parameters
#662
hfp
closed
1 year ago
0
Error with mpich 4.1: Type mismatch in argument 'baseptr' at (1); passed TYPE(c_ptr) to INTEGER(4)
#661
barracuda156
closed
1 year ago
26
ocl: flexible matching of tuned parameters
#660
hfp
closed
1 year ago
1
ocl: fixed regex in parameter-tuning script
#659
hfp
closed
1 year ago
0
ocl: match devices against tuned parameters based on device-id
#658
hfp
closed
1 year ago
1
ocl: accommodate directory structure of NVidia HPCSDK
#657
hfp
closed
1 year ago
0
Merged tuned parameters from V100 into A100-parameters
#656
hfp
closed
1 year ago
3
Run docker CI only from main repo
#655
RMeli
closed
1 year ago
1
Use memory pool also for Cannon send buffers
#654
oschuett
closed
1 year ago
3
turn off and remove codecoverage checks
#653
hfp
closed
1 year ago
3
ocl: mute warnings about potentially uninitialized data
#652
hfp
closed
1 year ago
0
gha: add macOS testing
#651
dev-zero
closed
1 year ago
0
WIP: Use vecLibFort instead of manual __ACCELERATE wrappers
#650
dev-zero
opened
1 year ago
0
ocl: test integration with #647
#649
hfp
closed
1 year ago
4
ocl: adjustments in anticipation of #647
#648
hfp
closed
1 year ago
0
WIP: Add GPU aware MPI support in cannon algorithm
#647
gsitaram
closed
7 months ago
13
Configure fails on macOS 10.7 and 10.10–10.13 due to Test f2008-norm2 failure
#646
barracuda156
closed
1 year ago
5
Two tests fail on macOS PPC: dbcsr_unittest2, dbcsr_unittest3
#645
barracuda156
opened
1 year ago
32
Build fails on macOS with fypp errors
#644
barracuda156
closed
1 year ago
1
Env vars
#643
alazzaro
closed
1 year ago
0
Rename DBCSR MPI output that is printed on top of each CP2K run
#642
JWilhelm
closed
1 year ago
1
Use env variables for setting CFG
#641
alazzaro
closed
1 year ago
1
ocl: fixed environment setup
#640
hfp
closed
1 year ago
0
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