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mirror of https://github.com/LCPQ/DEHam synced 2024-12-22 04:13:44 +01:00
Commit Graph

45 Commits

Author SHA1 Message Date
vijay
f3a56703ec
Merge branch 'master' into patch-2 2018-01-15 16:37:59 +01:00
vijay
5357361c12
cosmetics 2018-01-15 12:47:44 +01:00
vijay
31c7aa2694
export path for c compiler 2018-01-15 12:41:40 +01:00
Bouammali-MA
daa2efc254
Update of Read.md file
Addition of two lines 25 and 26. for solving C leading files path. and comment during export for process
2018-01-15 12:37:44 +01:00
vijay
52d361438b
Merge pull request #1 from Bouammali-MA/patch-1
Makefile Update
2018-01-15 12:35:56 +01:00
Bouammali-MA
4e5e4f36ec
Makefile Update
added in line 27 IRPF90_temp/ knowing that the requsted file should be in that directory.
2018-01-15 12:31:03 +01:00
vijay gopal chilkuri
934b7494e0 looks like its working with 1 proc 2016-12-21 19:09:11 +01:00
vijay gopal chilkuri
04acb8af41 working on density matrix 2016-12-21 18:43:41 +01:00
vijay gopal chilkuri
86b4621ea9 printing energies and s2 together 2016-12-21 17:49:39 +01:00
vijay gopal chilkuri
260daba4b2 removed redundant printing 2016-12-21 17:42:56 +01:00
vijay gopal chilkuri
9a7a10c37e now S2 is working 2016-12-21 17:41:39 +01:00
vijay gopal chilkuri
4d6525ecf7 still working on the bug 2016-12-21 14:40:34 +01:00
vijay gopal chilkuri
98dfbf4071 add S2 functionality but looks like theres a bug 2016-12-21 14:21:38 +01:00
vijay gopal chilkuri
9b3570c1ba now gets the determinant for a given adress 2016-12-21 13:59:01 +01:00
vijay gopal chilkuri
25451a4c9b add error checking 2016-12-21 13:33:13 +01:00
vijay gopal chilkuri
146030b8b9 now gets the determinant for a given adress 2016-12-21 13:08:15 +01:00
vijay gopal chilkuri
42ceea2ae9 now reads local values of eigenvector 2016-12-21 12:17:40 +01:00
vijay gopal chilkuri
39996be82e add error checking 2016-12-21 11:56:39 +01:00
vijay gopal chilkuri
5185407a4c values instead 2016-12-21 11:55:04 +01:00
vijay gopal chilkuri
2ca11527b5 add header to manipulate vectors 2016-12-21 11:54:14 +01:00
vijay gopal chilkuri
098f2bbdec trying to read array elements 2016-12-21 11:53:13 +01:00
vijay gopal chilkuri
85b10c2f62 added calculation of norm of resulting eigenvector 2016-12-21 11:41:15 +01:00
v1j4y
ee3afdd71e modified makefile to seperate into bin and lib dirs also now added neigenvalues option 2016-12-20 16:02:23 +01:00
vijay gopal chilkuri
a907d1a5fe added zenodo doi 2016-12-20 13:09:46 +01:00
vijay gopal chilkuri
d848afdba8 link should work now 2016-12-20 13:07:46 +01:00
vijay gopal chilkuri
8609f83da1 corrected link 2016-12-20 13:06:26 +01:00
vijay gopal chilkuri
e43d147c0f added publication 2016-12-20 13:05:02 +01:00
vijay gopal chilkuri
e669671ded general gcc version 2016-12-20 12:46:20 +01:00
vijay gopal chilkuri
1e6434c2e6 added clause 2016-12-20 12:38:03 +01:00
vijay gopal chilkuri
b71146a714 added licence file 2016-12-20 12:37:30 +01:00
vijay gopal chilkuri
83e44e9258 now trying with indentation 2016-12-20 12:29:39 +01:00
vijay gopal chilkuri
47e58159f2 still not working 2016-12-20 12:24:32 +01:00
vijay gopal chilkuri
1bfa87c73c list not working 2016-12-20 12:23:59 +01:00
vijay gopal chilkuri
a1997948e2 replaced dots with spaces 2016-12-20 12:23:07 +01:00
vijay gopal chilkuri
c9a58f1b33 added list in readme markdown 2016-12-20 12:21:51 +01:00
vijay gopal chilkuri
2b7485b7c6 added running instruction 2016-12-20 12:19:51 +01:00
vijay gopal chilkuri
c7756b318f added dependencies 2016-12-20 12:18:03 +01:00
vijay gopal chilkuri
88917b0c22 modified export variables 2016-12-20 12:14:59 +01:00
vijay gopal chilkuri
763ca132ef added readme 2016-12-20 12:12:48 +01:00
vijay gopal chilkuri
9a15a0cf9b now creates obj dir 2016-12-20 12:03:29 +01:00
vijay gopal chilkuri
a88be2315e added working makefile 2016-12-20 11:59:08 +01:00
vijay gopal chilkuri
8e909ea5d6 moved all files to src 2016-12-19 23:34:17 +01:00
vijay gopal chilkuri
833b297381 Merge branch 'master' of https://github.com/v1j4y/DEHam 2016-12-19 23:29:40 +01:00
vijay
9e53319521 Initial commit 2016-12-19 23:26:52 +01:00
vijay gopal chilkuri
79bdcfa221 initial commit 2016-12-19 23:26:16 +01:00