Commits · develop · QEF - Quantum Espresso Foundation / q-e

24 Jan, 2021 2 commits
- Merge branch 'fftxlib-error' into 'develop' · 7b94aa9b
  Ye Luo authored Jan 24, 2021
```
Fix error handling in FFTXlib

See merge request !1291
```
  7b94aa9b
- Typo correction. · 4d8d4526
  Ye Luo authored Jan 24, 2021
  
  4d8d4526
23 Jan, 2021 7 commits
- Merge branch 'remake_deps' into 'develop' · 79638c21
  giannozz authored Jan 23, 2021
```
Script for dependencies and make.depend updated

See merge request !1290
```
  79638c21
- Fix error handling in FFTXlib · c5b2a40c
  Ye Luo authored Jan 23, 2021
  
  c5b2a40c
- Script for dependencies and make.depend updated · 229be57e
  giannozz authored Jan 23, 2021
  
  229be57e
- Merge branch 'small_fixes' into 'develop' · a2f39e35
  giannozz authored Jan 23, 2021
```
Minor fixes

See merge request QEF/q-e!1288
```
  a2f39e35
- Merge branch 'fix-cmake-gpu' into 'develop' · a13bb0cf
  giannozz authored Jan 23, 2021
```
Fixed cmake files after cpu-gpu merge

See merge request QEF/q-e!1289
```
  a13bb0cf
- Fixed cmake files for cpu-gpu merge · d462b73a
  Daniele Cesarini authored Jan 23, 2021
  
  d462b73a
- Configure minor fixes; version number updated to 6.7GPU; · aacd111c
  giannozz authored Jan 23, 2021
```
bug fix in "cube" file by Satomichi Nisihara
```
  aacd111c
22 Jan, 2021 7 commits
- Merge branch 'merge_qegpu' into HEAD · db0da8b0
  Pietro Delugas authored Jan 22, 2021
  
  db0da8b0
- Merge branch 'clean_utxlib' into 'develop' · f4e957a3
  giannozz authored Jan 22, 2021
```
cuda_util.f90 is no longer needed

See merge request QEF/q-e!1286
```
  f4e957a3
- Merge branch 'smallthings' into 'develop' · be07a682
  giannozz authored Jan 22, 2021
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Doc: one misspell fixed, reference to github repository added

See merge request QEF/q-e!1287
```
  be07a682
- Merge branch 'syncqe8' into 'gpu-develop' · c75b94d3
  Pietro authored Jan 22, 2021
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Aligned q-e-gpu/develop to q-e/develop

See merge request !34
```
  c75b94d3
- Doc: one misspell fixed, reference to github repository added · b7175453
  giannozz authored Jan 22, 2021
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Only needed libraries used in Makefile for LAXlib
```
  b7175453
- cuda_util is now part of devxlib · 94b889c1
  Pietro authored Jan 22, 2021
  
  94b889c1
- Removed orphaned files · 9bdc78ac
  Pietro authored Jan 22, 2021
  
  9bdc78ac
21 Jan, 2021 5 commits
- Removed old implementation of GPU accelerated XC funcitonals · 5f297008
  Pietro authored Jan 21, 2021
  
  5f297008
- Do not compile old accelerated XC · c319983c
  Pietro authored Jan 21, 2021
  
  c319983c
- Merge branch 'develop' into syncqe8 · 0c285826
  Pietro authored Jan 21, 2021
  
  0c285826
- Merge branch 'pgi_and_beef' into 'develop' · 77e8f45e
  giannozz authored Jan 21, 2021
```
More PGI glitches with beef

See merge request q-e!1285
```
  77e8f45e
- More PGI glitches with beef · bdbba8dc
  giannozz authored Jan 21, 2021
```
pgcc v.19 (still used by the buildbot) needs -c11 to compile
```
  bdbba8dc
20 Jan, 2021 11 commits
- Merge branch 'reorg-xclib-beef' into 'develop' · e71c9604
  giannozz authored Jan 20, 2021
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[CMake] Split qe_libbeef target from qe_xclib

See merge request q-e!1284
```
  e71c9604
- Move libbeef files back to XClib due to Makefile. · ac846d8c
  Ye Luo authored Jan 20, 2021
  
  ac846d8c
- Move libbeef files to XClib/libbeef · 575a6192
  Ye Luo authored Jan 20, 2021
  
  575a6192
- Merge branch 'beef' into 'develop' · 568a0c48
  Ye Luo authored Jan 20, 2021
```
No external/libbeef

See merge request q-e!1283
```
  568a0c48
- Libbeef removed · 0b1e2aac
  giannozz authored Jan 20, 2021
  
  0b1e2aac
- Small libbeef alignment · 4e148c3c
  giannozz authored Jan 20, 2021
  
  4e148c3c
- Merge branch 'examples' into 'develop' · 587024dd
  giannozz authored Jan 20, 2021
```
Instructions for running examples collected into a single file

See merge request QEF/q-e!1280
```
  587024dd
- Merge branch 'XClib_minor' into 'develop' · 614c68e6
  giannozz authored Jan 20, 2021
```
XClib minor

See merge request QEF/q-e!1281
```
  614c68e6
- XClib test docs update · d3f5aa01
  Fabrizio Ferrari authored Jan 20, 2021
  
  d3f5aa01
- XClib test compilation fixes · 9b5d6aff
  Fabrizio Ferrari authored Jan 20, 2021
  
  9b5d6aff
- Note added to configure · b955360e
  giannozz authored Jan 20, 2021
  
  b955360e
19 Jan, 2021 3 commits
- Merge branch 'syncqe7' into 'gpu-develop' · b8776f49
  Pietro authored Jan 19, 2021
```
Align q-e-gpu/gpu-develop to q-e/develop

See merge request QEF/q-e-gpu!33
```
  b8776f49
- Aligned gpu-develop branch with develop from QEF/q-e. · d1ec367d
  Pietro authored Jan 19, 2021
  
  d1ec367d
- Instructions for running examples collected into a single file · 0b7c6cda
  giannozz authored Jan 19, 2021
  
  0b7c6cda
18 Jan, 2021 4 commits
- Merge branch 'develop-qe' into 'develop' · f561d59d
  giannozz authored Jan 18, 2021
```
fix a bug in noncollinear case

See merge request QEF/q-e!1279
```
  f561d59d
- Merge branch 'develop' into 'develop' · 8ba78bdd
  Ye Luo authored Jan 18, 2021
```
CMake support for CUDA

See merge request QEF/q-e!1267
```
  8ba78bdd
- Introduce CUDA support in CMake with some refactoring. · 586f66aa
  Daniele Cesarini authored Jan 18, 2021
  
  586f66aa
- fix a bug in noncollinear case · 78e82d1c
  Oscar Baseggio authored Jan 18, 2021
```
anda remove 2 useless initializations
```
  78e82d1c
16 Jan, 2021 1 commit
- Merge branch 'misc_fixes' into 'develop' · b9c4ed6d
  Ye Luo authored Jan 16, 2021
```
Fixes and doc

See merge request q-e!1278
```
  b9c4ed6d