Commits · 2b456c32c72474743fd7c1324f6ce9f8731ba957 · qbox / qbox-public

13 Jan, 2008 1 commit
- correct lda argument in blacs calls · 2b456c32
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@563 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Jan 13, 2008
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15 Dec, 2007 4 commits
- rel1_34_3 · ab303e33
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git-svn-id: http://qboxcode.org/svn/qb/trunk@561 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Dec 15, 2007
  ab303e33 Browse Files
- print warning msg only on task 0 · ab2345e7
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git-svn-id: http://qboxcode.org/svn/qb/trunk@560 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Dec 15, 2007
  ab2345e7 Browse Files
- fix XML comment in output · 0ad52808
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git-svn-id: http://qboxcode.org/svn/qb/trunk@559 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Dec 15, 2007
  0ad52808 Browse Files
- print info on species when loading a sample · c687abf2
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git-svn-id: http://qboxcode.org/svn/qb/trunk@558 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Dec 15, 2007
  c687abf2 Browse Files
29 Nov, 2007 17 commits
- rel1_34_2 · 43e5cd5c
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git-svn-id: http://qboxcode.org/svn/qb/trunk@556 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  43e5cd5c Browse Files
- updated xmlget build · 8e23dfeb
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git-svn-id: http://qboxcode.org/svn/qb/trunk@555 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
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- reverted to locally built atlas lib (precompiled Fedora6 lib causes crashes) · bca810e8
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git-svn-id: http://qboxcode.org/svn/qb/trunk@554 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
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- updated #includes · 2242af44
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git-svn-id: http://qboxcode.org/svn/qb/trunk@553 cba15fb0-1239-40c8-b417-11db7ca47a34
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  Francois Gygi committed Nov 29, 2007
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- added test on small (wf) grid · 448cc405
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git-svn-id: http://qboxcode.org/svn/qb/trunk@552 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
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- fixed bug for big endian platforms · 8acfa490
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git-svn-id: http://qboxcode.org/svn/qb/trunk@551 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  8acfa490 Browse Files
- New member create_contexts() · 09db290a
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git-svn-id: http://qboxcode.org/svn/qb/trunk@550 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  09db290a Browse Files
- Changed context allocation. Fixed update_occ, entropy for multiple k-points. · 0dd97468
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git-svn-id: http://qboxcode.org/svn/qb/trunk@549 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  0dd97468 Browse Files
- Fixed comments · 79acfa53
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git-svn-id: http://qboxcode.org/svn/qb/trunk@548 cba15fb0-1239-40c8-b417-11db7ca47a34
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  Francois Gygi committed Nov 29, 2007
  79acfa53 Browse Files
- Fixed print and write members · 5d94c175
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@547 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  5d94c175 Browse Files
- Multiple k-point and wf velocity functionality · eedb452f
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git-svn-id: http://qboxcode.org/svn/qb/trunk@546 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  eedb452f Browse Files
- Fix complex case · 73cf86f2
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git-svn-id: http://qboxcode.org/svn/qb/trunk@545 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
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- Fix comment · faf54a76
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git-svn-id: http://qboxcode.org/svn/qb/trunk@544 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  faf54a76 Browse Files
- Fix forces with k-points. Fix bug introduced in 1.34.0. · 4dfd4a36
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git-svn-id: http://qboxcode.org/svn/qb/trunk@543 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  4dfd4a36 Browse Files
- use zcopy syntax instead of zcopy_ · 9473e997
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git-svn-id: http://qboxcode.org/svn/qb/trunk@542 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  9473e997 Browse Files
- fix CP dynamics with k-points · ce1060ea
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@541 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  ce1060ea Browse Files
- fix forces and stress with k-points · 6d4f5f33
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@540 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 29, 2007
  6d4f5f33 Browse Files
08 Nov, 2007 1 commit


git-svn-id: http://qboxcode.org/svn/qb/trunk@538 cba15fb0-1239-40c8-b417-11db7ca47a34

committed Nov 08, 2007

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31 Oct, 2007 13 commits
- rel1_34_1 · 32bce6f6
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git-svn-id: http://qboxcode.org/svn/qb/trunk@537 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  32bce6f6 Browse Files
- *** empty log message *** · 1e97b61b
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git-svn-id: http://qboxcode.org/svn/qb/trunk@536 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  1e97b61b Browse Files
- use /usr/lib64 libs · 52686b74
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git-svn-id: http://qboxcode.org/svn/qb/trunk@535 cba15fb0-1239-40c8-b417-11db7ca47a34
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  Francois Gygi committed Oct 31, 2007
  52686b74 Browse Files
- use /usr/lib64 libraries · 8dbe85f9
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@534 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  8dbe85f9 Browse Files
- fixed k-point functionality · 5fe12e5d
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@533 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  5fe12e5d Browse Files
- fixed comment · 575a09ff
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git-svn-id: http://qboxcode.org/svn/qb/trunk@532 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  575a09ff Browse Files
- fixed print and write functions · c89bd139
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@531 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  c89bd139 Browse Files
- added zheevd. · 4adc91cc
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@530 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  4adc91cc Browse Files
- added zheevd. Fixed work size calculation in pzheev (scalapack problem) · 724639b7
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@529 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  724639b7 Browse Files
- fixed k-point functionality · 992da0d0
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@528 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  992da0d0 Browse Files
- increased ft grid size to avoid aliasing when using k!=0 · 7ac7dfe1
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@527 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  7ac7dfe1 Browse Files
- improve output format · 0eec218b
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@526 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  0eec218b Browse Files
- create wf velocity if absent · 636f1536
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@525 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Oct 31, 2007
  636f1536 Browse Files
20 Oct, 2007 1 commit

BLAS lib corrected · 9068b01c


git-svn-id: http://qboxcode.org/svn/qb/trunk@523 cba15fb0-1239-40c8-b417-11db7ca47a34

committed Oct 20, 2007

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19 Oct, 2007 3 commits

kpoints modifs · 16b5cf07


git-svn-id: http://qboxcode.org/svn/qb/trunk@522 cba15fb0-1239-40c8-b417-11db7ca47a34

committed Oct 19, 2007

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kpoints modifs · 0e1b782c


git-svn-id: http://qboxcode.org/svn/qb/trunk@521 cba15fb0-1239-40c8-b417-11db7ca47a34

committed Oct 19, 2007

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initial revision · d75be547


git-svn-id: http://qboxcode.org/svn/qb/trunk@520 cba15fb0-1239-40c8-b417-11db7ca47a34

committed Oct 19, 2007

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