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Topics Author Replies Views Last Modified
a suggestionalex117702006/11/29 14:17
by T.Ozaki
Trouble reading standard inputVasilii Artyukhov117512006/11/29 14:00
by T.Ozaki
Constraint_Opt/DIIS in OPENMX 3.1Thomas Gallauner117892006/11/29 13:20
by T.Ozaki
Can you show me to detail use of OpenMX program?Mr.Cong119812006/11/22 02:03
by Pavel
about charged moleculeXinyuan Zhang225072006/11/22 01:13
by Xinyuan Zhang
q: charges? basis sets/potentials validation?Grigory219592006/11/18 22:59
by Grigory
Bug fixed in OpenMX3.1, No.2T.Ozaki016892006/11/17 00:44
by T.Ozaki
Initial spin charges question?Dung Tien221392006/11/15 22:38
by Dung Tien
Bug fixed in OpenMX3.1, No.1T.Ozaki017002006/11/13 15:45
by T.Ozaki
install problem for 3.1 versonLiger Chen116342006/11/10 18:26
by Liger Chen
Does B-Bop do DOS?Vasilii Artyukhov215552006/11/09 22:04
by Vasilii Artyukhov
the molecular orbitalXinyuan Zhang121002006/11/09 11:15
by T.Ozaki
DOS of hcp Gd metalDr. Xubo Liu024022006/11/06 03:34
by Dr. Xubo Liu
Magnetic moment in cubic SrRuO3JessK342742006/11/05 00:05
by T.Ozaki
Memory UsageKevin219752006/11/04 06:41
by JessK
non convergence calculation problem!sabri123212006/11/04 02:12
by T.Ozaki
OpenMX Ver.3.1 availableT.Ozaki015132006/11/04 01:48
by T.Ozaki
Velocities in MDPavel114942006/11/04 01:28
by T.Ozaki
DosMain question.Liger Chen117332006/11/04 01:26
by T.Ozaki
error while testing Methane.datKevin219532006/11/03 20:40
by Kevin
Polarization in BaTiO3jessK131632006/11/01 10:15
by T.Ozaki
LDA+U energyjessK220932006/10/18 23:06
by jessK
runtest problem in opteronh. Jeong116992006/10/12 23:56
by T.Ozaki
is it possible for plus diffuse orbital ?Liger Chen118722006/10/12 23:01
by T.Ozaki
Binding energy calculationK. Bart126372006/10/12 22:52
by T.Ozaki
error message ...p4_error: interrupt SIGSEGV: 11..Liger Chen179142006/10/12 22:36
by T.Ozaki
Transition state search on OpenMXDung Tien219972006/10/04 11:10
by Dung Tien
STM imagePavel116462006/10/03 23:23
by T.Ozaki
Segmentation Fault for openMX MPI version 3.0KC425562006/09/29 14:31
by T.Ozaki
Dr.Hyuk Soon Choi220352006/09/29 09:31
by Hyuk Soon Choi
scf converge problem Liger Chen223102006/09/26 16:01
by Liger Chen
Hard to converge for geometric optimizer.Xinyuan Zhang716652006/09/21 16:56
by Xinyuan
what is the meaning of the error warning ?Liger Cheb340112006/09/20 14:56
by Liger Chen
Calculation of Work Function with Yukihiro Okuno127142006/09/19 10:53
by T.Ozaki
B-BOPXinyuan Zhang119162006/09/19 10:41
by T.Ozaki
Help with NVT Si Bulk SimulationRavi M220782006/08/25 12:51
by Ravi M
Misschristine116082006/08/18 12:58
by T.Ozaki
memory issuesjessK117062006/08/11 09:10
by T.Ozaki
A unknown problemXinyuan Zhang117312006/08/11 09:02
by T.Ozaki
Tetrahedron method applicabilityVasilii Artyukhov119922006/08/11 09:00
by T.Ozaki
A question about basis setPeter Winey223462006/07/10 23:49
by Peter Winey
Forces and symmetryPeter Winey222932006/07/10 23:28
by Peter Winey
Database (2006) of PAO and VPS availableT.Ozaki220532006/06/30 23:54
by Peter Winey
Installation - undefined referenceJan123502006/06/27 23:11
by Jan
How to fix the fault of running large-scale systemGn. Plott117722006/06/16 11:32
by T.Ozaki
magnetic momentjessK320992006/06/14 11:30
by T.Ozaki
adpack1.8: first deriv. discont. of excited statesM. Gusso118872006/06/13 22:10
by T.Ozaki
adpack1.8: high grid.xmax parameterM. Gusso119702006/06/13 22:02
by T.Ozaki
Band, Cluster, and DC ?F Li118012006/06/13 21:50
by T.Ozaki
LBFGS optimizerjessK117762006/06/06 20:34
by T.Ozaki

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