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Topics Author Replies Views Last Modified
error of negfWeiqi Lee06442015/03/13 19:09
by Weiqi Lee
A unable to understand problem in NEGF calculationWeiqi Lee06912015/03/13 18:44
by Weiqi Lee
Optical propertiese of GrapheneSmart17212015/03/10 13:36
by T. Ozaki
What does d1~d5 mean in PDOS file?Seungjin27342015/03/04 13:00
by Seungjin
openmx and linux distributionMosahhar1011832015/03/02 19:03
by marcindulak
Output files on HPC facilitiesMauro Sgroi16152015/02/26 09:40
by T. Ozaki
DFT+U: different oxidation states on the same element (charge ordering)Mauro Sgroi28032015/02/23 23:27
by Mauro Sgroi
Pseudo-potential for fictitious atomsPR38302015/02/23 03:21
by PR
Patch 3.7.10 to OpenMX Ver. 3.7T. Ozaki07382015/02/21 23:16
by T. Ozaki
Patch 3.7.9 to OpenMX Ver. 3.7T. Ozaki28442015/02/21 22:50
by marcindulak
atomic structure for NEGFDarek59202015/02/20 19:31
by Darek
Small problem in bandgnu13 fileSeungjin16842015/02/20 16:57
by T. Ozaki
installation problemMosahhar18182015/02/20 13:18
by T. Ozaki
OpenMX consumes memory and diesArtem Pulkin17572015/02/20 13:15
by T. Ozaki
Compile Error!masoud1247402015/02/19 00:05
by Masoud
scf convergence problem on Iron based supercell consisting of 484 atomsYueqiang Gu59142015/02/11 11:47
by Yueqiang Gu
scf convergence problem of Pt(111) slabWang Yuanqing1013202015/02/10 21:45
by T. Ozaki
pseudo-atomic basis orbitalsRiemann18672015/02/10 21:38
by T. Ozaki
how to read *.md file using XCrySDen softwareWang Yuanqing310162015/02/10 19:13
by Denis Music
Total energy in NEGFArtem Pulkin64652015/01/29 18:56
by Artem Pulkin
Transmisson through siliceneVahid06802015/01/22 20:23
by Vahid
MLWF obtained from OpenMXGuodong Yu49282015/01/22 11:10
by Guodong Yu
Electrostatic potential between leads in NEGF transport calculationsKonstantin Khromov27062015/01/20 19:45
by Konstantin Khromov
gcc errorWilliam17882014/12/15 14:27
by T.V.T. Duy
problem about example Gly_NH.datWang Yuanqing27232014/12/12 10:46
by Yuanqing Wang
The 3rd OpenMX/QMAS workshopT. Ozaki08792014/12/11 23:56
by T. Ozaki
mismatched energy values on same symmetry pointsKuraya37252014/12/11 22:12
by T. Ozaki
no error no run!masoud16332014/12/11 01:24
by Artem Pulkin
md calculation errorWang Yuanqing17752014/12/10 19:09
by Artem Pulkin
PAO and VPS for CarbonKonstantin Khromov28522014/11/27 06:26
by T. Ozaki
DoctorKonstantin Khromov16952014/11/26 20:29
by Konstantin Khromov
INput file for Bi2Se3ANANT18382014/11/24 20:12
by Artem Pulkin
Writing the code for (1,1,1) surface for any crystal ANANT16562014/11/23 08:29
by T. Ozaki
Question about non-collinear MLWF calculationLimillas110032014/11/23 08:26
by T. Ozaki
VPS and PAO for TerbiumM. M. Anas27882014/11/21 19:05
by M. M. Anas
NEGF and insulatorsArtem Pulkin18142014/11/21 00:09
by T. Ozaki
Fe spin numbersSepideh27822014/11/15 02:12
by sepideh
discrepancies results between openmx-siesta-vasp on slab calculation without vdwDuverger Eric212352014/11/14 06:30
by Duverger
I had some error when I tried to install openMXWang Yuanqing29942014/11/12 15:01
by Yuanqing Wang
Transmission Through SiliceneVahid110122014/11/03 19:12
by Artem Pulkin
Installing Openmx with Ifort and IccVahid215912014/10/31 22:23
by Vahid
including hybrid functionalMosahhar08672014/10/28 16:17
by Mosahhar
DFT-D2 Julieth212012014/10/28 04:59
by Julieth
problem with band interpolation using HS.outM. Chen121332014/10/27 22:48
by T. Ozaki
O(N) method in OpenmxChen112882014/10/27 22:41
by T. Ozaki
patches for gcc-4.8.3/4.9.1marcindulak19052014/10/27 22:30
by T. Ozaki
Optimized norm-conserving Vanderbilt pseudopotentialschrinide115652014/10/27 22:26
by T. Ozaki
localised and itinerant electron specificationTamal Goswami119512014/10/27 22:18
by T. Ozaki
Compile ErrorHossein131802014/09/25 18:43
by Artem Pulkin
Transport Properties in Charged CompoundsLeone211622014/09/16 01:21
by Leone

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