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Topics Author Replies Views Last Modified
BaTiO3 optical conductivitytigercuong025912007/03/12 20:14
by tigercuong
Could you show me how to use DFTcalculation for QDMr.CuongNT123702007/02/21 14:04
by Xinyuan Zhang
Selenium basis set shyam127692007/02/20 19:48
by Vasilii.Artyukhov
undefined "Valence_Electrons"Huiqun Zhou022862007/02/11 13:49
by Huiqun Zhou
Problem about compilation errorjacket Su228622007/02/08 02:10
by jacket Su
tips for PP generationDenis Music326702007/02/08 00:20
by Denis Music
I couldn't have installed OpenMX3.1!!! Help meCongkhtn019572007/02/05 14:14
by Congkhtn
B-BOP againVasilii Artyukhov024952007/01/31 00:53
by Vasilii Artyukhov
Runtest problemZsolt242132007/01/22 18:22
by Zsolt
adapack1.8 - Generate_VNL.c routineMichele Gusso021292007/01/17 19:19
by Michele Gusso
Adpack and partial core correctionGuillaume Lucas119382007/01/16 00:02
by Guillaume Lucas
large systemsJessK322762007/01/13 01:27
by jessK
Happy New Year to All OpenMX Users!Dung Tien023272006/12/31 12:15
by Dung Tien
Dimer binding energyAlexandre Tkatchenko851862006/12/28 00:22
by T.Ozaki
small suggestionhungdt119072006/12/18 19:32
by T.Ozaki
Ceperly Alder Exchange-CorrelationMichele Gusso123222006/12/07 11:51
by T.Ozaki
coud you show me how to setup OnpenMX in Win Oper?Mr.Cong724232006/12/06 05:15
by alex
PublicationsVasilii Artyukhov320802006/12/05 23:56
by Vasilii Artyukhov
How to construct peudopotential of fictitious atomXinyuan Zhang320862006/12/01 23:49
by Vasilii Artyukhov
opteron compilation errorAloysius124412006/12/01 18:23
by T.Ozaki
About Transport calculationHai-Ping Lan325532006/12/01 10:53
by T.Ozaki
Charged System calculationHai-Ping Lan118862006/11/29 14:31
by T.Ozaki
a suggestionalex117992006/11/29 14:17
by T.Ozaki
Trouble reading standard inputVasilii Artyukhov117762006/11/29 14:00
by T.Ozaki
Constraint_Opt/DIIS in OPENMX 3.1Thomas Gallauner118142006/11/29 13:20
by T.Ozaki
Can you show me to detail use of OpenMX program?Mr.Cong120222006/11/22 02:03
by Pavel
about charged moleculeXinyuan Zhang225302006/11/22 01:13
by Xinyuan Zhang
q: charges? basis sets/potentials validation?Grigory219912006/11/18 22:59
by Grigory
Bug fixed in OpenMX3.1, No.2T.Ozaki017282006/11/17 00:44
by T.Ozaki
Initial spin charges question?Dung Tien221652006/11/15 22:38
by Dung Tien
Bug fixed in OpenMX3.1, No.1T.Ozaki017302006/11/13 15:45
by T.Ozaki
install problem for 3.1 versonLiger Chen116602006/11/10 18:26
by Liger Chen
Does B-Bop do DOS?Vasilii Artyukhov215822006/11/09 22:04
by Vasilii Artyukhov
the molecular orbitalXinyuan Zhang121322006/11/09 11:15
by T.Ozaki
DOS of hcp Gd metalDr. Xubo Liu024332006/11/06 03:34
by Dr. Xubo Liu
Magnetic moment in cubic SrRuO3JessK343042006/11/05 00:05
by T.Ozaki
Memory UsageKevin220012006/11/04 06:41
by JessK
non convergence calculation problem!sabri123462006/11/04 02:12
by T.Ozaki
OpenMX Ver.3.1 availableT.Ozaki015372006/11/04 01:48
by T.Ozaki
Velocities in MDPavel115202006/11/04 01:28
by T.Ozaki
DosMain question.Liger Chen117572006/11/04 01:26
by T.Ozaki
error while testing Methane.datKevin219892006/11/03 20:40
by Kevin
Polarization in BaTiO3jessK131902006/11/01 10:15
by T.Ozaki
LDA+U energyjessK221282006/10/18 23:06
by jessK
runtest problem in opteronh. Jeong117282006/10/12 23:56
by T.Ozaki
is it possible for plus diffuse orbital ?Liger Chen118942006/10/12 23:01
by T.Ozaki
Binding energy calculationK. Bart126732006/10/12 22:52
by T.Ozaki
error message ...p4_error: interrupt SIGSEGV: 11..Liger Chen179822006/10/12 22:36
by T.Ozaki
Transition state search on OpenMXDung Tien220242006/10/04 11:10
by Dung Tien
STM imagePavel116762006/10/03 23:23
by T.Ozaki

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