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List of Threads Topics Author Replies Views Last Modified unit cell optimization Philip 0 2036 2009/07/21 06:20 by Philip Low memory utility rate kuofeng 0 2179 2009/06/18 18:43 by kuofeng Cube file for each time step Spelnikov Dmitry 0 2099 2009/06/10 19:43 by Spelnikov Dmitry Bug in the function "Band_DFT_MO_NonCol" in every version Jeong 0 2054 2009/06/04 23:01 by Jeong openmx suspected memory leak? Alin M Elena 0 2440 2009/05/20 19:00 by Alin M Elena Parallel runs crash on one cluster but not the other Baruch Feldman 1 2501 2009/05/08 18:52 by Baruch Feldman Definition of chemical potential in OPENMX Loc Duong Dinh 1 2261 2009/04/10 23:29 by Loc Duong Dinh Generation of a Pseudopotential for gold Giovani Faccin 0 2831 2009/03/21 03:11 by Giovani Faccin question about installation----CC&LIB rocdawn 2 1659 2009/03/19 14:31 by rocdawn kutu Xiang He 0 1334 2009/03/16 16:37 by Xiang He openmx(242) malloc: ***vm_allocate(size=8421376) failed (error code=3) YuYe Tong 1 2962 2009/03/04 14:35 by H Jeong nan MulP in Cluster solver Jian Zhou 5 3332 2009/03/03 16:37 by Jian Zhou Bond Order Potential Igarashi 0 2272 2009/02/06 13:58 by Igarashi Segmentation fault with example input file CG15c-Kry.dat Joseph Driscoll 0 2281 2009/01/15 03:33 by Joseph Driscoll A bug with tabulator in the input file Pavel Sorokin 0 2131 2009/01/12 15:30 by Pavel Sorokin Problem in geometry optimization of C nanotube Prachi 1 2682 2009/01/06 11:47 by JH Parq Problems for Optical Conductivity!!! Yen-Hsun Su 0 2347 2008/12/20 16:42 by Yen-Hsun Su problem with cohesive energies Vlad 3 3400 2008/12/11 21:58 by Vasilii Artyukhov identifier "Rcv_FNAN2_GRc" is undefined Daniel Schwen 1 2237 2008/12/03 16:43 by T.Ozaki error in installation openmx3.4 Esthela Contreras 0 1556 2008/12/03 08:47 by Esthela Contreras problem with installation Esthela Contreras 0 1461 2008/12/03 05:19 by Esthela Contreras To calculate dielectric constant Gunn Kim 0 2104 2008/11/27 14:44 by Gunn Kim Problem with openmp/mpi Kevin 1 1761 2008/11/09 01:46 by Kevin Be careful for U values JH Parq 0 2389 2008/11/08 10:17 by JH Parq geometry optimization problem Yuzheng Guo 0 1069 2008/11/04 00:02 by Yuzheng Guo Segmentation fault in executing openmx? xue_bin wu 0 108 2008/11/02 04:03 by xue_bin wu Errors when compiling DosMain V3.4 Yonghong Zhao 7 226 2008/10/25 01:25 by Kyriakos Kachrimanis Bug report : Empty atom failure on OpenMX 3.4 H. Jeong 0 2149 2008/10/22 10:23 by H. Jeong appropriate Band.KPath.UnitCell and Band.Nkpath settings Kyriakos Kachrimanis 0 1640 2008/10/07 02:46 by Kyriakos Kachrimanis Relaxation of large system with defect, using new Eigenvalue-Following(EF) method Heungsik Kim 1 2480 2008/10/01 16:02 by Heungsik Kim Openmx linking problem Mauro Sgroi 1 2499 2008/10/01 01:13 by Mauro Sgroi comile error in openmx3.4 Jaber Jahanbin 3 3083 2008/09/24 14:25 by Heungsik Kim Complex band structure R K Pandey 0 2336 2008/09/11 10:37 by R K Pandey give a help about installation: parallel compilation Nauy Nux 0 2495 2008/08/19 01:01 by Nauy Nux how to switch off symmetry Zhu Xi 0 1475 2008/08/04 16:55 by Zhu Xi parallel compilation problem Xun Yuan 1 3070 2008/07/29 10:53 by Duong Dinh Loc weird and unreasonable total energies in Si-bulk geometry relaxation Mauro 0 2522 2008/07/26 05:11 by Mauro Problem When test openmx with Alpha E45 machine Duong Dinh Loc 0 2163 2008/07/24 00:18 by Duong Dinh Loc a problem in installation of openMX3.4 Xun Yuan 1 1878 2008/07/15 22:56 by Mauro I have problemes in openmx installation on fedora 8 Jaber Jahanbin Sardr 3 2542 2008/07/15 05:55 by Jaber Jahanbin Sardr Question about Poles and residues in the ...code Liger Chen 0 1632 2008/07/03 20:16 by Liger Chen ADPACK Ver. 2.1 and OpenMX Ver. 3.4 were released T.Ozaki 1 300 2008/07/01 10:09 by pem orbital optimization problem:scaling factor diverging Mauro 1 2441 2008/06/27 18:08 by Mauro OpenMx installation on Asus G2P laptop Naoto 3 3930 2008/06/27 18:06 by Naoto Reg Au_PBE.vps Deepak 1 2628 2008/06/27 11:52 by Yonghong Zhao A question about DOSs of Si & Al Yonghong Zhao 2 2576 2008/06/12 22:52 by Yonghong Zhao Too violet variation of "Uele" value under Electric field calculation ? Fuh Huei-Ru 2 1938 2008/06/12 20:20 by Huei-Ru Fuh Can I increase the number of point when calculating DOS? Yonghong Zhao 2 1598 2008/06/12 10:28 by Yonghong Zhao bccFe, the Fermi level is error? Yonghong Zhao 2 2167 2008/06/12 09:47 by Yonghong Zhao The discontinue output data of "filename.tden.cube"? Fuh Huei-Ru 1 2485 2008/06/11 11:38 by T.Ozaki

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