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OrderN
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CONQUEST-release
Full public release of large scale and linear scaling DFT code CONQUEST
http://www.order-n.org/
MIT License
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Memory error associated with LibXC module
#299
davidbowler
closed
2 months ago
2
Extended scaling up to 262,144 atom case
#298
davidbowler
closed
3 months ago
0
Add ID strings to matrix multiplication kernels and write out
#297
davidbowler
closed
3 months ago
0
Turn pointers into allocatables in structures
#296
tkoskela
opened
4 months ago
1
debugging and code cleanup
#295
tkoskela
closed
4 months ago
1
Remove pointers in multiply module
#294
tkoskela
opened
5 months ago
2
Fix multiply kernel memory leak
#293
tkoskela
closed
4 months ago
3
Test all multiply kernels in CI
#292
tkoskela
closed
3 months ago
4
Test multiply kernels in CI
#291
tkoskela
closed
5 months ago
1
Overlap communication with computation in multiply_module
#290
ilectra
opened
5 months ago
2
Problem with starting Conquest compiled with GCC v13
#289
davidbowler
closed
3 months ago
3
Revert breaking changes to develop
#288
tkoskela
closed
5 months ago
0
Compilation error on develop branch
#287
AugustinLu
closed
5 months ago
2
Develop
#286
lionelalexandre
closed
5 months ago
0
fix hard-coded scalapack link flag
#285
tkoskela
closed
5 months ago
2
Manual updates for Padding Hamiltonian
#284
tsuyoshi38
closed
6 months ago
0
Add more ways to specify integration grid and BZ sampling
#283
davidbowler
opened
6 months ago
0
Fix all benchmarks to output to stdout
#282
tkoskela
closed
6 months ago
0
Record the matrix multiply kernel used in output
#281
davidbowler
closed
3 months ago
1
Memory leak for linear scaling ompGemm_m kernel on atom movement
#280
davidbowler
closed
4 months ago
14
Update spack package
#279
tkoskela
closed
5 months ago
1
Further threading ideas: spin and van der Waals
#278
davidbowler
opened
6 months ago
0
Make develop the default branch?
#277
tkoskela
opened
7 months ago
0
Multi threading exact exchange
#276
tkoskela
closed
3 weeks ago
9
Document benchmark systems
#275
ilectra
opened
7 months ago
0
Format of the forces in extXYZ output file.
#274
AugustinLu
closed
3 months ago
7
Ensure that all file open commands fail gracefully
#273
davidbowler
opened
7 months ago
0
Version Control system.make for different machines
#272
ilectra
closed
7 months ago
5
Version Control system.make for different machines
#271
ilectra
closed
7 months ago
0
Test different multiply kernels in testsuite
#270
tkoskela
closed
3 weeks ago
6
Test longer matrix ranges in matrix multiply
#269
tkoskela
closed
7 months ago
1
Investigate performance of other multiply kernels
#268
tkoskela
closed
7 months ago
2
Set omp_stacksize in testsuite
#267
tkoskela
closed
7 months ago
1
Optimise threading in ompGemm multiply kernel
#266
tkoskela
closed
7 months ago
0
Overlap communication with computation in multiply_module
#265
tkoskela
opened
7 months ago
2
Run weak scaling tests
#264
tkoskela
opened
7 months ago
3
Add documentation for installing with Spack
#263
tkoskela
closed
2 months ago
0
Add input configurations used for profiling
#262
ilectra
closed
7 months ago
2
Store inputs for performance tests
#261
tkoskela
closed
7 months ago
0
Read distance units from input file
#260
davidbowler
closed
7 months ago
2
Post-processing does not check for distance units
#259
davidbowler
closed
7 months ago
1
F xsf xyz write frequency
#258
AugustinLu
closed
6 months ago
1
Fix issues with eigenvalue output format
#257
davidbowler
closed
7 months ago
1
Inadequate formatting in eigenvalue output file
#256
davidbowler
closed
5 months ago
1
Output frequency for xsf and xyz trajectories
#255
AugustinLu
closed
3 months ago
4
OMP_STACKSIZE should be set for testsuite
#254
davidbowler
closed
7 months ago
0
Implementation of variable temperature
#253
AugustinLu
closed
3 months ago
3
Think about threaded ScaLAPACK alternatives for eigenvalue solve
#252
tkoskela
opened
8 months ago
0
Combine single_PAO_to_grid and single_PAO_to_grad
#251
tkoskela
closed
7 months ago
2
Idea: Test do concurrent
#250
tkoskela
opened
8 months ago
0
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