OpenMX Forum
New Thread
|
Return Home
|
Mailing List
|
Points of Concern
|
Search
|
Past Log
|
Administration
List of Threads
Topics
Author
Replies
Views
Last Modified
electric field
Ruibin Liu
1
1581
2013/06/04 21:00
by T. Ozaki
Patch 3.7.3 to OpenMX Ver. 3.7
T. Ozaki
0
1806
2013/06/03 17:24
by T. Ozaki
Hybrid functional B3LYP
Ruibin Liu
1
1676
2013/06/03 09:59
by T. Ozaki
openmx 3.7 on intel_64
Denis Music
5
5135
2013/05/31 14:29
by Denis Music
openmx3.7 Installation problem
SH
5
11123
2013/05/29 20:42
by Tamal Goswami
Patch 3.7.2 to OpenMX Ver. 3.7
T. Ozaki
0
1680
2013/05/29 17:37
by T. Ozaki
Patch 3.7.1 to OpenMX Ver. 3.7
T. Ozaki
0
1365
2013/05/27 14:56
by T. Ozaki
2013 database for heavy elements
James
1
1503
2013/05/24 20:47
by T. Ozaki
Release of OpenMX Ver. 3.7
T. Ozaki
0
1224
2013/05/23 12:02
by T. Ozaki
Exact exchange and hybrid functionals
Mauro Sgroi
2
1628
2013/05/16 23:15
by Mauro Sgroi
Can we specify the bias voltage applied to the left and right lead, respectively?
Yasutaka Nishida
2
1929
2013/05/16 19:17
by Yasutaka Nishida
How to compute the phonon dispersion by openmx
T.Morshedloo
0
1730
2013/04/30 17:34
by T.Morshedloo
segmentation fault during <logical truncation>
Ruibin Liu
0
1281
2013/04/18 10:26
by Ruibin Liu
question on FeO_NC.dat input file
sanjeev
0
1589
2013/03/25 17:15
by sanjeev
How to visualize charge density using Xcrysdens
Joao Amaral
2
3121
2013/03/19 20:21
by Joao Amaral
Energy convergence requirements
Alfonso
0
1363
2013/03/15 23:52
by Alfonso
Producing desired spin state
Tamal Goswami
0
1381
2013/02/27 17:40
by Tamal Goswami
Convergence issue of CoFe/MgO/CoFe sytem (MTJ)
H.Park
0
2224
2013/02/25 15:45
by H.Park
Basis vectors of Heusler alloy
idu
2
1876
2013/02/06 21:11
by idu
Energy of Fermi, HOMO and LUMO
zhe
0
1724
2013/01/18 23:36
by zhe
Memory problem?
pesonkr
0
1737
2013/01/18 12:24
by pesonkr
optical conductivity
Pavel Serba
3
1966
2013/01/12 02:52
by PavelSerba
Zero Point Energy (ZPE) correction
Nima
0
1786
2013/01/11 02:53
by Nima
installation
Zahra
1
2579
2013/01/10 20:25
by surender
Numerical error of force and total energy by the Gauss-Legendre quadrature in Total_Energy.c
A. M. Ito
2
2472
2012/12/28 13:41
by A. M. Ito
Installation error on Fedora 17
Wang daobin
1
3432
2012/12/28 07:03
by Surender
pseudopotentials for Lanthanide
Fraser
0
1344
2012/12/20 13:55
by Fraser
computations of adsorption of NO on TiO2
marzi
0
1775
2012/12/02 19:24
by marzi
Fe/MgO/Fe calculation
Kamaram Munira
0
2093
2012/12/01 00:55
by Kamaram Munira
Problems with convergence
Jan Rusz
3
2495
2012/11/30 22:54
by Jan Rusz
Transport calculation in Fe-MgO-Fe system, LEFT lead cannot be superposed on the original cell
Kamaram
0
1954
2012/11/27 02:24
by Kamaram
Node in Be 2s wavefunction
Dario Mitnik
0
1396
2012/11/22 23:48
by Dario Mitnik
problem with 'Automatic Running Test"
Surender
1
2873
2012/11/12 23:21
by 10412009
Input file creation for my molecules
kannan
0
1298
2012/11/07 05:53
by kannan
Input file for Bismuth
Mehmood
0
1374
2012/11/06 21:54
by Mehmood
Error: TRAN_Calc_SurfGreen in NEGF calculation
jahanbin
0
1362
2012/11/05 15:52
by jahanbin
Force on the nucleus of an atom under the external electric field
H
2
1697
2012/10/29 01:41
by H
Problem with Copper hard pseudopotential
Alfonso
2
1867
2012/10/20 00:52
by Alfonso
overlap probleme in negf calculations
Jahanbin
0
1652
2012/10/15 04:36
by Jahanbin
Installation problem
Nourdine
12
8232
2012/09/27 11:31
by Anant
NEGF calculation using restart
P
0
1535
2012/09/25 01:59
by P
Pseudopotential vps file
Kwangwoo
2
1557
2012/09/24 16:47
by Kwangwoo
How to calculate <Sx>, <Sy> and <Sz> with Open-Mx
José Eduardo Padilha
1
5710
2012/09/23 18:33
by T.Ozaki
erro: NEGF calculation with different right and left lead
wang
1
2074
2012/09/23 17:00
by wang
band structure of YN
IDRIS
1
1835
2012/09/11 07:28
by T.Ozaki
GaAs DOS
Dariusz Chrobak
4
2355
2012/09/10 23:55
by T.Ozaki
Gate voltage reference for NEGF transport calculations
P
2
1898
2012/09/10 21:29
by P
same PAOs
Julio Aguiar
4
1712
2012/09/03 23:59
by Julio Aguiar
Silicon cd force calculations
Dariusz Chrobak
2
2645
2012/08/29 18:34
by Dariusz Chrobak
installation with openmpi
sanjeev
1
1502
2012/08/28 17:44
by T. Ozaki
Page: [
1
] [
2
] [
3
] [
4
] [
5
] [
6
] [
7
] [
8
] [
9
] [
10
] [
11
] [
12
] [
13
] [
14
]
[15]
[
16
] [
17
] [
18
] [
19
] [
20
] [
21
] [
22
] [
23
] [
24
]
Open Thread
Locked Thread
Alarm(More than 180 replies)
Message from Administrator
-
Web Patio
-