Timeline


and .

03/12/10:

13:20 Changeset [6352] by fulvio
I forgot to erase a useless print

03/11/10:

20:01 Changeset [6351] by dstrubbe
*) Added option for verbose SCF output from finite-difference calculation. …
16:00 Changeset [6350] by fulvio
I modified the k-points grid generation scheme: now the (full) k-p. grid …

03/09/10:

21:38 Changeset [6349] by dstrubbe
*) Finite-difference em_resp calculations can now restart from stored …
03:12 Changeset [6348] by dstrubbe
Some trivial capitalization and hyphenation.

03/08/10:

22:28 Changeset [6347] by dstrubbe
*) Improved formatting *) Added push_sub's *) Changed single-letter …
22:05 Changeset [6346] by acastro
o Removed the special handling of global.F90 in src/basic/Makefile.am. Now …

03/06/10:

04:57 Changeset [6345] by dstrubbe
*) Improved formatting *) Added push_sub's *) Fixed intent's to suppress …
03:38 Changeset [6344] by dstrubbe
*) Improved formatting and comments *) Added push_sub's, and removed one …

03/05/10:

21:42 Changeset [6343] by dstrubbe
The (y + z) field calculation can now be omitted in finite difference …

03/04/10:

01:25 Changeset [6342] by dstrubbe
*) Added missing dependencies *) Removed unused parameter of rmmdiis_start …

03/03/10:

21:08 Changeset [6341] by dstrubbe
*) Improvements to formatting, comments, output, documentation *) Changed …
18:04 Changeset [6340] by helbig
modified call to KS iteration to allow future use in td
06:21 Changeset [6339] by dstrubbe
Fixed a mistake in test.
02:34 Changeset [6338] by dstrubbe
*) Previous commit forgot to mention two changes: 1) The variable …
01:13 Changeset [6337] by dstrubbe
*) Improvements to comments, formatting, output *) Removed debugging …
00:10 Changeset [6336] by dstrubbe
*) Improvements to formatting and comments *) Changed variable …

03/02/10:

23:12 Changeset [6335] by dstrubbe
*) The zero-field dipole is now written in restart/em_resp_fd/dipoles for …
15:55 Changeset [6334] by marques
This is an overkill hack in order for libxc to compile with different …
07:33 Changeset [6333] by dstrubbe
Removed some variables now unused after my reorganization of LCAO calls.
00:40 Changeset [6332] by dstrubbe
Setting svn:ignore for directories generated if you install into the trunk …
00:37 Changeset [6331] by dstrubbe
*) For more information to the user, finite differences em_resp prints the …
00:26 Changeset [6330] by dstrubbe
*) Tweaks to warning messages *) Restoring the lcao_done variable: it …
00:21 Changeset [6329] by dstrubbe
Set svn:ignore for new files being created in libxc.

03/01/10:

20:48 Changeset [6328] by dstrubbe
*) Finite-difference em_resp calculations can now start each SCF with …
20:44 Changeset [6327] by helbig
replaced calls to scf with calls to eigensolver, fixed laplacian …

02/26/10:

16:37 Changeset [6326] by marques
Libtools puts libxc.a in a different place…
16:22 Changeset [6325] by marques
Stupid hack to go around buggy libtool/automake. This works in tddft.org, …
15:42 Changeset [6324] by marques
Let's see if this fixes the compilations issues. Needless to say that it …
14:01 Changeset [6323] by marques
Added the option to compile libxc dynamically, and a target to create …
03:57 Changeset [6322] by dstrubbe
A few trivial changes.

02/25/10:

22:46 Changeset [6321] by dstrubbe
*) gs, go, and unocc run modes each had their own very similar code for …

02/24/10:

21:32 Changeset [6320] by dstrubbe
*) Changed variables to more meaningful/standard names *) Improved …
20:40 Changeset [6319] by dstrubbe
*) Improvements to output, code formatting, comments *) Alphabetized …
03:14 Changeset [6318] by dstrubbe
*) Changed single-letter variables *) Changed real(8) to REAL_DOUBLE: …

02/23/10:

19:27 Changeset [6317] by dstrubbe
Specified the full criteria for the default for LCAO, as given in the …
16:38 Changeset [6316] by fnog
The LCAOStart default value is lcao_full, but the documentation mentions …
03:33 Changeset [6315] by dstrubbe
Removed some excessive white space in variable documentation, and …

02/16/10:

19:52 Changeset [6314] by dstrubbe
Made some type conversions explicit to suppress compiler warnings.
13:56 Changeset [6313] by joseba
Comments changed to fit the documentation

02/12/10:

15:01 Changeset [6312] by marques
I added the possibility to turn off the subspace diagonalization that was …

02/10/10:

03:13 Changeset [6311] by dstrubbe
I think it is more logical to speak of deallocation in error messages than …
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