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Author
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Last Modified
Convergence of NEGF for defective GNRs
S Dechamps
6
1305
2016/11/10 20:07
by S Dechamps
how to match the DOS of NEGF with The transmission
Pavan choudary
3
822
2016/11/09 17:28
by Pavan choudary
Patch 3.8.1 to OpenMX Ver. 3.8
T. Ozaki
0
787
2016/10/21 15:50
by T. Ozaki
Manual setting of occupation numbers
Jan-Niclas
8
1097
2016/10/20 17:22
by T. Ozaki
Implementation of EDM using the continued fraction representation of Fermi function
Ari Ojanperä
1
858
2016/10/18 00:07
by T. Ozaki
Problem about Mulliken population analysis
duan
2
1040
2016/10/16 23:12
by T. Ozaki
Analysis of NEGF results
Rohit
2
810
2016/10/16 22:31
by TO
PAOs for anions
Daniil
1
823
2016/10/16 22:09
by T. Ozaki
DIIS geometry optimization
Nikhil
2
986
2016/10/16 21:55
by T. Ozaki
Bychkov-Rashba effect is dependent on the relative position of the system in the cell
Dubois S.
2
962
2016/10/16 21:45
by T. Ozaki
alignment of band structure with vaccum level
Renato Borges Pontes
2
793
2016/10/16 19:03
by T. Ozaki
magnetic anisotropy energy calculated seems wrong!
Shekoufe Khosravi
2
936
2016/10/16 19:01
by T. Ozaki
error on make TranMain with Ubuntu 14.04 LTS
Diego
0
898
2016/10/05 07:00
by Diego
error on make DosMain with Ubuntu 14.04 LTS
Diego
0
872
2016/10/05 06:57
by Diego
How Generate TranMain and DosMain package on OpenMX on Ubuntu 14.04 LTS?
Diego Castillo V.
0
804
2016/10/04 03:27
by Diego Castillo V.
NEGF Calculation Hanging
Peter
2
809
2016/10/03 20:21
by Peter
Installation Manual of OpenMX 3.7.6-1 on Linux (Ubuntu 14.04 LTS)
Diego Castillo
0
2092
2016/09/29 03:25
by Diego Castillo
Installation Problem OpenMX 3.7
Diego Castillo
2
1009
2016/09/29 02:59
by Diego Castillo
Convergence Issue: Very High Value of Uele
Nikhil
2
1106
2016/09/22 13:40
by Nikhil
installation error 3.8
pavan choudary
0
728
2016/09/20 16:58
by pavan choudary
Installation 3.8
Krishna
2
954
2016/09/10 19:06
by Krishna
Exchange coupling parameter program (jx)
Joao Amaral
6
1660
2016/09/06 16:58
by Hongkee Yoon
Error points in Band Structure of SrVO3
Priya Dey
1
965
2016/09/04 21:05
by T. Ozaki
MBJLDA
Sehoon Oh
1
997
2016/09/02 12:06
by T. Ozaki
Can openMX simulate few layer graphene
John Chen
1
917
2016/08/30 18:15
by Artem Pulkin
the question of bandgap and covalent bond
John Chen
4
1013
2016/08/30 17:18
by John Chen
Question about setting up angles in non-collinear DFT
Hung-Yu Yang
1
779
2016/08/30 16:30
by T. Ozaki
scf band calculations for different number of layers
Rohit
3
826
2016/08/29 14:39
by T. Ozaki
openmx3.7 error
zahra
1
1216
2016/08/25 23:10
by Riemann
openmx3.8 error
zahra
0
891
2016/08/25 21:38
by zahra
There is a rigid shift toward negative energy in the band structure of MoS2 monolayer
Nadia Salami
1
953
2016/08/22 12:50
by T. Ozaki
Release of OpenMX Viewer Ver. 1.0
T. Ozaki
0
1153
2016/08/20 01:34
by T. Ozaki
Projected band structure
Riemann
6
2197
2016/08/19 15:45
by Riemann
Projected Bandstructure with Unfolding Method
Riemann
6
1595
2016/08/17 03:44
by Riemann
Error in making DosMain
saeid amjadian
0
797
2016/08/12 21:42
by saeid amjadian
question regarding to plot up-spin and down-spin bands in noncollinear DFT calculations
Nadia Salami
1
1015
2016/08/12 18:36
by T. Ozaki
STM by WSXM
Lida
3
1530
2016/08/11 22:01
by T. Ozaki
Software for Density of state files ?
Rohit
1
798
2016/08/10 16:01
by T. Ozaki
OpenMX3.8 installation problem
Yohei Ibe
2
1145
2016/08/05 11:24
by Yohei Ibe
converting band file to GNUBAND,BANDDAT1 file
RG
3
999
2016/08/03 15:08
by T. Ozaki
version of intel compiler
Sung
1
864
2016/08/03 13:31
by T. Ozaki
Reduce timing of NEGF for Al
Hiroya Nakata
1
974
2016/08/02 17:15
by Artem Pulkin
problems with plotting the band structure.
Rohit Goel
1
1071
2016/07/29 16:23
by Rohit Goel
Band unfolding for supercells with additional atoms
Nikolai Zaitsev
2
1043
2016/07/28 21:25
by Nikolai Zaitsev
Error in NEGF
Keshav Raheja
2
1063
2016/07/28 02:00
by Keshav Raheja
Incomplete NEGF run with correct transmission vs energy result
Vipin Kumar
3
1171
2016/07/26 19:42
by Artem Pulkin
Band Structure of Black phosphorous
Rohit Goel
2
957
2016/07/22 11:59
by Rohit Goel
PAOs of lead atoms can overlap only to the next nearest region
Vipin Kumar
10
1185
2016/07/18 20:18
by Vipin Kumar
Do the molecular orbitals obtained by openmx include the factor exp(ikr)?
Xiangyang Peng
2
414
2016/07/14 18:25
by Xiangyang Peng
Phosphorene Real Space Hmiltonian
Riemann
3
1257
2016/07/11 22:11
by Artem Pulkin
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