Commits · 45bc8761ed94e9ba5d5dc3822a7046eac9653ad8 · qbox / qbox-public

09 Nov, 2010 3 commits


git-svn-id: http://qboxcode.org/svn/qb/trunk@829 cba15fb0-1239-40c8-b417-11db7ca47a34

committed Nov 09, 2010

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initial revision · 5a09bfec


git-svn-id: http://qboxcode.org/svn/qb/trunk@828 cba15fb0-1239-40c8-b417-11db7ca47a34

committed Nov 09, 2010

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Qbox utilities · fb82c896


git-svn-id: http://qboxcode.org/svn/qb/trunk@827 cba15fb0-1239-40c8-b417-11db7ca47a34

committed Nov 09, 2010

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04 Nov, 2010 1 commit
- modif for testreadSample · a82ce850
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@826 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 04, 2010
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03 Nov, 2010 6 commits
- updated dependecies · 5e1d8057
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@824 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 03, 2010
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- rel1_52_2 · 51cbccb8
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@823 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 03, 2010
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- Updated help message · dda67b39
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@822 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 03, 2010
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- rel1_52_2 · bba1a890
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@821 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 03, 2010
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- Enable reading of sample containing no wavefunctions (atomset only) · d8501dea
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@820 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 03, 2010
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- Disable wf extrapolation if nite > 1 · e9412b6d
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@819 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Nov 03, 2010
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24 Sep, 2010 1 commit
- Fixed printing of matrix dimensions · 28195668
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@818 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Sep 24, 2010
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19 Aug, 2010 1 commit
- echo commands in <cmd> </cmd> elements · 47367287
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@817 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Aug 19, 2010
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12 Jun, 2010 1 commit

Added <eigenset> tag. · c438f033


git-svn-id: http://qboxcode.org/svn/qb/trunk@802 cba15fb0-1239-40c8-b417-11db7ca47a34

committed Jun 12, 2010

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10 May, 2010 12 commits

moved to uuid_str · 4d207370


git-svn-id: http://qboxcode.org/svn/qb/trunk@799 cba15fb0-1239-40c8-b417-11db7ca47a34

committed May 10, 2010

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added string header · b81829cf


git-svn-id: http://qboxcode.org/svn/qb/trunk@797 cba15fb0-1239-40c8-b417-11db7ca47a34

committed May 10, 2010

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print empty row error for all k points. · 8db1cbd9
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@796 cba15fb0-1239-40c8-b417-11db7ca47a34
```
Francois Gygi committed May 10, 2010
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uuid changed to uuid_str · 5d398488
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@795 cba15fb0-1239-40c8-b417-11db7ca47a34
```
Francois Gygi committed May 10, 2010
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cleaned up arguments of zherk, pzherk. · e000e184
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@794 cba15fb0-1239-40c8-b417-11db7ca47a34
```
Francois Gygi committed May 10, 2010
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cleaned up arguments of pzherk. · 468e98e6
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@793 cba15fb0-1239-40c8-b417-11db7ca47a34
```
Francois Gygi committed May 10, 2010
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set beta=0 in complex herk call. · 5c1f1875

removed incorrect cleanup of Im(c(G=0)) in complex case.


git-svn-id: http://qboxcode.org/svn/qb/trunk@792 cba15fb0-1239-40c8-b417-11db7ca47a34

committed May 10, 2010

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rel1_52_1 · f2715125


git-svn-id: http://qboxcode.org/svn/qb/trunk@791 cba15fb0-1239-40c8-b417-11db7ca47a34

committed May 10, 2010

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rel1_52_1 · ececd86f


git-svn-id: http://qboxcode.org/svn/qb/trunk@790 cba15fb0-1239-40c8-b417-11db7ca47a34

committed May 10, 2010

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use uuid_str() instead of uuid() · 4eb696ab
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@789 cba15fb0-1239-40c8-b417-11db7ca47a34
```
Francois Gygi committed May 10, 2010
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use preinstalled atlas · 86fee060
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@788 cba15fb0-1239-40c8-b417-11db7ca47a34
```
Francois Gygi committed May 10, 2010
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moved uuid to new file name · 7ca6122e
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@787 cba15fb0-1239-40c8-b417-11db7ca47a34
```
Francois Gygi committed May 10, 2010
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16 Apr, 2010 12 commits
- rel1_52_0 · a1b4c023
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@785 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- added rescale_v command · 55b0ab42
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@784 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- OpenMP prototype implementation · f10ba6fa
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@783 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- Bussi-Donadio-Parrinello thermostat · cbbbd1df
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@782 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- utility functions for normal and gamma deviates · 95c27401
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@781 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- added sampling.o dependency · 0a14ce2c
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@780 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- Added Bussi-Donadio-Parrinello option (BDP) · 6902e5dc
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@779 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- added ekin_stepper member · 1df08017
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@778 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- added ekin_stepper to econst · 72af15c5
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@777 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- rescale_v command · 23ee1533
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@776 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- added rescale_velocities member · 8da5db71
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@775 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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- trailing blanks · c5b2ecc1
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@774 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 16, 2010
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07 Apr, 2010 3 commits
- Added missing initialization of mloc_, nloc_ in ctors. · 809ab3a0
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@772 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 07, 2010
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- rel1_51_1 · 6347de81
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@771 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 07, 2010
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- Fixed dependencies. · db165d8c
```
git-svn-id: http://qboxcode.org/svn/qb/trunk@770 cba15fb0-1239-40c8-b417-11db7ca47a34
```
  Francois Gygi committed Apr 07, 2010
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