51 Commits

This Branch

This Branch

All Branches

Author	SHA1	Message	Date
vijay	198aa1bf4f	cosmetics	2018-01-26 13:12:50 +01:00
vijay	2e6f7d646e	add new input file features	2018-01-26 13:12:12 +01:00
vijay	0526613506	Update README.md	2018-01-15 23:30:38 +01:00
vijay	f13054d927	removed tabs after merge	2018-01-15 16:43:52 +01:00
vijay	91471cf823	Merge pull request #2 from Bouammali-MA/patch-2 ... Update of Read.md file	2018-01-15 16:42:48 +01:00
vijay	2a72a065eb	Merge branch 'master' into patch-2	2018-01-15 16:42:28 +01:00
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