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Topics
Author
Replies
Views
Last Modified
Turning off calculation of forces
Felipe Jornada
1
1055
2015/03/26 13:37
by T. Ozaki
bandstructure problem
Mosahar
11
1369
2015/03/25 20:59
by Mosahar
prallel installation
Haider Abbas
1
1045
2015/03/25 01:03
by sungwoojang
PDOS for arbitrary orbital
Seungjin
3
1396
2015/03/16 18:01
by Seungjin
Reza
Behjatmanesh
1
1393
2015/03/13 23:26
by Reza
error of negf
Weiqi Lee
0
1033
2015/03/13 19:09
by Weiqi Lee
A unable to understand problem in NEGF calculation
Weiqi Lee
0
1026
2015/03/13 18:44
by Weiqi Lee
Optical propertiese of Graphene
Smart
1
1054
2015/03/10 13:36
by T. Ozaki
What does d1~d5 mean in PDOS file?
Seungjin
2
1170
2015/03/04 13:00
by Seungjin
openmx and linux distribution
Mosahhar
10
1730
2015/03/02 19:03
by marcindulak
Output files on HPC facilities
Mauro Sgroi
1
967
2015/02/26 09:40
by T. Ozaki
DFT+U: different oxidation states on the same element (charge ordering)
Mauro Sgroi
2
1185
2015/02/23 23:27
by Mauro Sgroi
Pseudo-potential for fictitious atoms
PR
3
1381
2015/02/23 03:21
by PR
Patch 3.7.10 to OpenMX Ver. 3.7
T. Ozaki
0
1064
2015/02/21 23:16
by T. Ozaki
Patch 3.7.9 to OpenMX Ver. 3.7
T. Ozaki
2
1188
2015/02/21 22:50
by marcindulak
atomic structure for NEGF
Darek
5
1392
2015/02/20 19:31
by Darek
Small problem in bandgnu13 file
Seungjin
1
1005
2015/02/20 16:57
by T. Ozaki
installation problem
Mosahhar
1
1236
2015/02/20 13:18
by T. Ozaki
OpenMX consumes memory and dies
Artem Pulkin
1
1128
2015/02/20 13:15
by T. Ozaki
Compile Error!
masoud
12
6974
2015/02/19 00:05
by Masoud
scf convergence problem on Iron based supercell consisting of 484 atoms
Yueqiang Gu
5
1402
2015/02/11 11:47
by Yueqiang Gu
scf convergence problem of Pt(111) slab
Wang Yuanqing
10
1966
2015/02/10 21:45
by T. Ozaki
pseudo-atomic basis orbitals
Riemann
1
1503
2015/02/10 21:38
by T. Ozaki
how to read *.md file using XCrySDen software
Wang Yuanqing
3
1718
2015/02/10 19:13
by Denis Music
Total energy in NEGF
Artem Pulkin
6
928
2015/01/29 18:56
by Artem Pulkin
Transmisson through silicene
Vahid
0
1063
2015/01/22 20:23
by Vahid
MLWF obtained from OpenMX
Guodong Yu
4
1395
2015/01/22 11:10
by Guodong Yu
Electrostatic potential between leads in NEGF transport calculations
Konstantin Khromov
2
1080
2015/01/20 19:45
by Konstantin Khromov
gcc error
William
1
1181
2014/12/15 14:27
by T.V.T. Duy
problem about example Gly_NH.dat
Wang Yuanqing
2
1100
2014/12/12 10:46
by Yuanqing Wang
The 3rd OpenMX/QMAS workshop
T. Ozaki
0
1213
2014/12/11 23:56
by T. Ozaki
mismatched energy values on same symmetry points
Kuraya
3
1051
2014/12/11 22:12
by T. Ozaki
no error no run!
masoud
1
938
2014/12/11 01:24
by Artem Pulkin
md calculation error
Wang Yuanqing
1
1143
2014/12/10 19:09
by Artem Pulkin
PAO and VPS for Carbon
Konstantin Khromov
2
1290
2014/11/27 06:26
by T. Ozaki
Doctor
Konstantin Khromov
1
1028
2014/11/26 20:29
by Konstantin Khromov
INput file for Bi2Se3
ANANT
1
1311
2014/11/24 20:12
by Artem Pulkin
Writing the code for (1,1,1) surface for any crystal
ANANT
1
977
2014/11/23 08:29
by T. Ozaki
Question about non-collinear MLWF calculation
Limillas
1
1556
2014/11/23 08:26
by T. Ozaki
VPS and PAO for Terbium
M. M. Anas
2
1121
2014/11/21 19:05
by M. M. Anas
NEGF and insulators
Artem Pulkin
1
1162
2014/11/21 00:09
by T. Ozaki
Fe spin numbers
Sepideh
2
1122
2014/11/15 02:12
by sepideh
discrepancies results between openmx-siesta-vasp on slab calculation without vdw
Duverger Eric
2
1792
2014/11/14 06:30
by Duverger
I had some error when I tried to install openMX
Wang Yuanqing
2
1398
2014/11/12 15:01
by Yuanqing Wang
Transmission Through Silicene
Vahid
1
1368
2014/11/03 19:12
by Artem Pulkin
Installing Openmx with Ifort and Icc
Vahid
2
1992
2014/10/31 22:23
by Vahid
including hybrid functional
Mosahhar
0
1422
2014/10/28 16:17
by Mosahhar
DFT-D2
Julieth
2
1510
2014/10/28 04:59
by Julieth
problem with band interpolation using HS.out
M. Chen
1
2520
2014/10/27 22:48
by T. Ozaki
O(N) method in Openmx
Chen
1
1601
2014/10/27 22:41
by T. Ozaki
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