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Topics Author Replies Views Last Modified
Trouble reading standard inputVasilii Artyukhov122232006/11/29 14:00
by T.Ozaki
Constraint_Opt/DIIS in OPENMX 3.1Thomas Gallauner122872006/11/29 13:20
by T.Ozaki
Can you show me to detail use of OpenMX program?Mr.Cong125792006/11/22 02:03
by Pavel
about charged moleculeXinyuan Zhang229702006/11/22 01:13
by Xinyuan Zhang
q: charges? basis sets/potentials validation?Grigory224852006/11/18 22:59
by Grigory
Bug fixed in OpenMX3.1, No.2T.Ozaki023102006/11/17 00:44
by T.Ozaki
Initial spin charges question?Dung Tien226632006/11/15 22:38
by Dung Tien
Bug fixed in OpenMX3.1, No.1T.Ozaki023172006/11/13 15:45
by T.Ozaki
install problem for 3.1 versonLiger Chen121232006/11/10 18:26
by Liger Chen
Does B-Bop do DOS?Vasilii Artyukhov220432006/11/09 22:04
by Vasilii Artyukhov
the molecular orbitalXinyuan Zhang126422006/11/09 11:15
by T.Ozaki
DOS of hcp Gd metalDr. Xubo Liu029432006/11/06 03:34
by Dr. Xubo Liu
Magnetic moment in cubic SrRuO3JessK348262006/11/05 00:05
by T.Ozaki
Memory UsageKevin224642006/11/04 06:41
by JessK
non convergence calculation problem!sabri129112006/11/04 02:12
by T.Ozaki
OpenMX Ver.3.1 availableT.Ozaki019842006/11/04 01:48
by T.Ozaki
Velocities in MDPavel120082006/11/04 01:28
by T.Ozaki
DosMain question.Liger Chen122312006/11/04 01:26
by T.Ozaki
error while testing Methane.datKevin225242006/11/03 20:40
by Kevin
Polarization in BaTiO3jessK136862006/11/01 10:15
by T.Ozaki
LDA+U energyjessK226482006/10/18 23:06
by jessK
runtest problem in opteronh. Jeong121772006/10/12 23:56
by T.Ozaki
is it possible for plus diffuse orbital ?Liger Chen123252006/10/12 23:01
by T.Ozaki
Binding energy calculationK. Bart133892006/10/12 22:52
by T.Ozaki
error message ...p4_error: interrupt SIGSEGV: 11..Liger Chen188682006/10/12 22:36
by T.Ozaki
Transition state search on OpenMXDung Tien225262006/10/04 11:10
by Dung Tien
STM imagePavel121212006/10/03 23:23
by T.Ozaki
Segmentation Fault for openMX MPI version 3.0KC431752006/09/29 14:31
by T.Ozaki
Dr.Hyuk Soon Choi225782006/09/29 09:31
by Hyuk Soon Choi
scf converge problem Liger Chen228022006/09/26 16:01
by Liger Chen
Hard to converge for geometric optimizer.Xinyuan Zhang725632006/09/21 16:56
by Xinyuan
what is the meaning of the error warning ?Liger Cheb345162006/09/20 14:56
by Liger Chen
Calculation of Work Function with Yukihiro Okuno132862006/09/19 10:53
by T.Ozaki
B-BOPXinyuan Zhang123782006/09/19 10:41
by T.Ozaki
Help with NVT Si Bulk SimulationRavi M225852006/08/25 12:51
by Ravi M
Misschristine121302006/08/18 12:58
by T.Ozaki
memory issuesjessK121572006/08/11 09:10
by T.Ozaki
A unknown problemXinyuan Zhang123402006/08/11 09:02
by T.Ozaki
Tetrahedron method applicabilityVasilii Artyukhov125982006/08/11 09:00
by T.Ozaki
A question about basis setPeter Winey227962006/07/10 23:49
by Peter Winey
Forces and symmetryPeter Winey229892006/07/10 23:28
by Peter Winey
Database (2006) of PAO and VPS availableT.Ozaki225572006/06/30 23:54
by Peter Winey
Installation - undefined referenceJan128262006/06/27 23:11
by Jan
How to fix the fault of running large-scale systemGn. Plott122212006/06/16 11:32
by T.Ozaki
magnetic momentjessK328792006/06/14 11:30
by T.Ozaki
adpack1.8: first deriv. discont. of excited statesM. Gusso123302006/06/13 22:10
by T.Ozaki
adpack1.8: high grid.xmax parameterM. Gusso124882006/06/13 22:02
by T.Ozaki
Band, Cluster, and DC ?F Li122912006/06/13 21:50
by T.Ozaki
LBFGS optimizerjessK122712006/06/06 20:34
by T.Ozaki
K-point gridjessK125452006/06/06 10:46
by T.Ozaki

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