July 2003 Archives by date

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Starting: Tue Jul 1 03:04:04 CEST 2003
Ending: Thu Jul 31 20:15:49 CEST 2003
Messages: 276

• [Wien] Constructing lattice harmonics from "real" spherical harmonics   Gus Hart
• [Wien] error about shared libraries   Li Yonghua
• big jumps in E (Re: [Wien] a question on convergence)   Steven Homolya
• [Wien] mkl + debian   Steven Homolya
• [Wien] Constructing lattice harmonics from "real" spherical harmonics   whoming
• [Wien] mkl + debian   Li Wang
• big jumps in E (Re: [Wien] a question on convergence)   Peter Blaha
• [Wien] error about shared libraries   Peter Blaha
• [Wien] Constructing lattice harmonics from "real" spherical harmonics   Peter Blaha
• [Wien] Constructing lattice harmonics from "real" spherical harmonics   Peter Blaha
• [Wien] Optics with spin-orbit interaction   Peter Blaha
• [Wien] Emax !   Peter Blaha
• [Wien] mkl + debian   Steven Homolya
• [Wien] linux distribution   Sergio L. Palacios
• [Wien] linux distribution   thomas.mazet
• [Wien] question about segmentation fault   Torsten Andersen
• [Wien] Constructing lattice harmonics from "real" spherical harmonics   Gus Hart
• [Wien] Question again! Pease help!   Ma Chi Chiu
• [Wien] Constructing lattice harmonics from "real" spherical harmonics   Peter Blaha
• [Wien] fermi error   Ercan Ucgun
• [Wien] fermi error   Stefaan Cottenier
• [Wien] Klist for tetragonal structure   Maria Reza
• [Wien] How p-DOS calculated?   whoming
• [Wien] Klist for tetragonal structure   Peter Blaha
• [Wien] How p-DOS calculated?   Kevin Jorissen
• [Wien] Question again! Pease help!   Kevin Jorissen
• [Wien] which forces does mini use   Kevin Jorissen
• [Wien] linux distribution   Kevin Jorissen
• [Wien] which forces does mini use   Stefaan Cottenier
• [Wien] e-test: subscript out of range   Ad Ettema
• [Wien] e-test: subscript out of range   Stefaan Cottenier
• [Wien] which forces does mini use   Peter Blaha
• [Wien] linux distribution   Sergio L. Palacios
• [Wien] e-test: subscript out of range   Peter Blaha
• [Wien] e-test: subscript out of range   Ingo Loa
• [Wien] Fw: Re: [WIEN]: Using Wien2k on RedHat9.0   Kevin Jorissen
• [Wien] error in optic   Eric.Duverger
• [Wien] e-test: subscript out of range   Stefaan Cottenier
• [Wien] e-test: subscript out of range   Ad Ettema
• save btw runs?? (Re: [Wien] e-test: subscript out of range)   Steven Homolya
• save btw runs?? (Re: [Wien] e-test: subscript out of range)   Stefaan Cottenier
• [Wien] WIEN and Mathematical libraries under Linux   Ruben Weht
• [Wien] WIEN and Mathematical libraries under Linux   Stefaan Cottenier
• [Wien] CuAlO2 delafossite structure file   Wenqing ZHANG
• [Wien] calculation on neutral or charged defect   Yushan Wang
• [Wien] calculation on neutral or charged defect   Stefaan Cottenier
• [Wien] calculation on neutral or charged defect   Yushan Wang
• [Wien] about how to decide the bacground charge   Yushan Wang
• [Wien] about how to decide the bacground charge   Kevin Jorissen
• [Wien] Bandstructure not matching DOS   Moises Iglesias Gonzalez
• [Wien] Bandstructure not matching DOS   Torsten Andersen
• [Wien] Klist for tetragonal structure   Jutta Rogal
• [Wien] about how to decide the bacground charge   Yushan Wang
• [Wien] How p-DOS calculated?   whoming
• [Wien] It's being hached?   Li Yonghua
• [Wien] zero energy   Kevin Jorissen
• [Wien] Bandstructure not matching DOS   Moises Iglesias Gonzalez
• [Wien] Bandstructure not matching DOS   Stefaan Cottenier
• [Wien] zero energy   Stefaan Cottenier
• [Wien] Bandstructure not matching DOS   Moises Iglesias Gonzalez
• [Wien] Bandstructure not matching DOS   Stefaan Cottenier
• Follow-up Qns. to {Re: [Wien] zero energy} + cohesive E   Steven Homolya
• Follow-up Qns. to {Re: [Wien] zero energy} + cohesive E   Stefaan Cottenier
• Follow-up Qns. to {Re: [Wien] zero energy} + cohesive E   Steven Homolya
• [Wien] parallel calc. without NFS   Steven Homolya
• [Wien] digest viewer   Steven Homolya
• [Wien] plotting conduction state densities   Fred Nastos
• [Wien] parallel calc. without NFS   Stefaan Cottenier
• [Wien] plotting conduction state densities   Georg Madsen
• Follow-up Qns. to {Re: [Wien] zero energy} + cohesive E   Kevin Jorissen
• [Wien] How p-DOS calculated?   Kevin Jorissen
• [Wien] parallel calc. without NFS   Kevin Jorissen
• [Wien] parallel calc. without NFS   Stefaan Cottenier
• [Wien] Problem with jumping forces   Veerle Vanhoof
• [Wien] parallel calc. without NFS   Steven Homolya
• [Wien] parallel calc. without NFS   Kevin Jorissen
• [Wien] parallel calc. without NFS   Stefaan Cottenier
• [Wien] plotting conduction state densities   David Pankhurst
• [Wien] parallel calc. without NFS   Kevin Jorissen
• [Wien] parallel calc. without NFS   Jeff Spirko
• [Wien] parallel calc. without NFS   Steven Homolya
• [Wien] plotting conduction state densities   Fred Nastos
• [Wien] plotting conduction state densities   Fred Nastos
• [Wien] parallel calc. without NFS   Torsten Andersen
• [Wien] plotting conduction state densities   Georg Madsen
• [Wien] troubles in LAPW1   Sergio L. Palacios
• [Wien] troubles in LAPW1   Li Wang
• [Wien] troubles in LAPW1   Kevin Jorissen
• [Wien] about how to decide the bacground charge   Kevin Jorissen
• [Wien] It's being hached?   Kevin Jorissen
• [Wien] about how to decide the bacground charge   Stefaan Cottenier
• [Wien] digest viewer   Kevin Jorissen
• [Wien] 'stop - follow, nstep > maxfoll' in aim   Kevin Jorissen
• [Wien] Bandstructure with band character   yulihua-wuhan
• [Wien] Bandstructure with band character   akara at ksu.edu
• [Wien] How p-DOS calculated?   whoming
• note on scratch (Re: [Wien] troubles in LAPW1)   Steven Homolya
• note on scratch (Re: [Wien] troubles in LAPW1)   Torsten Andersen
• [Wien] digest viewer   Javier Fuhr
• [Wien] Re: Re: [WIEN]: Using Wien2k on RedHat9.0   David Pankhurst
• [Wien] Re: Re: [WIEN]: Using Wien2k on RedHat9.0   David Pankhurst
• [Wien] 'stop - follow, nstep > maxfoll' in aim   Javier Fuhr
• [Wien] Bandstructure with band character   yulihua-wuhan
• [Wien] core dump   Kirk Feindel
• note on scratch (Re: [Wien] troubles in LAPW1)   Steven Homolya
• [Wien] how to calculate the formation energy of doped crystal   Yushan Wang
• [Wien] Problem with jumping forces   Peter Blaha
• [Wien] parallel calc. without NFS   Peter Blaha
• [Wien] 'stop - follow, nstep > maxfoll' in aim   Peter Blaha
• [Wien] parallel calc. without NFS   Steven Homolya
• [Wien] parallel calc. without NFS   Torsten Andersen
• [Wien] Problem with jumping forces   Stefaan Cottenier
• [Wien] parallel calc. without NFS   Peter Blaha
• [Wien] have you met such question   Yushan Wang
• [Wien] about the "total energy"   Yushan Wang
• [Wien] parallel calc. without NFS   Steven Homolya
• [Wien] have you met such question   Steven Homolya
• [Wien] lcore change from wien2k_02 to wien2k_03   Natalie Holzwarth
• [Wien] parallel calc. without NFS   Peter Blaha
• [Wien] lcore change from wien2k_02 to wien2k_03   Peter Blaha
• [Wien] about the "total energy"   Peter Blaha
• [Wien] parallel calc. without NFS   Kevin Jorissen
• [Wien] Compile errors   Michael Frotscher
• [Wien] parallel calc. without NFS   Steven Homolya
• [Wien] Compile errors   Torsten Andersen
• [Wien] Compile errors   Peter Blaha
• [Wien] Compile errors   Sorin Lazar
• [Wien] lcore change from wien2k_02 to wien2k_03   Natalie Holzwarth
• [Wien] Compile errors   Michael Frotscher
• [Wien] lcore change from wien2k_02 to wien2k_03   Peter Blaha
• [Wien] Compile errors   H Demers
• [Wien] Compile errors   H. Demers
• [Wien] Compile errors   Jeff Spirko
• [Wien] LDA & LSDA Problem   Sherif Yehia
• [Wien] LDA & LSDA Problem   Kevin Jorissen
• [Wien] Re: [WIEN]: 100atomfix_lapw annihilates some lm's   Kevin Jorissen
• [Wien] Compile errors   Michael Frotscher
• [Wien] (no subject)   GengHua
• [Wien] Re: [WIEN]: 100atomfix_lapw annihilates some lm's   Peter Blaha
• [Wien] Compile errors   Peter Blaha
• [Wien] (no subject)   Robert Laskowski
• [Wien] Compile errors   Michael Frotscher
• [Wien] Re: [WIEN]: 100atomfix_lapw annihilates some lm's   Kevin Jorissen
• [Wien] f90 compiler   Mohammed Abujafar
• [Wien] f90 compiler   Pio Bättig
• [Wien] f90 compiler   Michael Frotscher
• [Wien] f90 compiler   Mohammed Abujafar
• [Wien] f90 compiler   Mohammed Abujafar
• [Wien] Re: [WIEN]: 100atomfix_lapw annihilates some lm's   Kevin Jorissen
• [Wien] Re: [WIEN]: 100atomfix_lapw annihilates some lm's   Peter Blaha
• [Wien] Re: [WIEN]: 100atomfix_lapw annihilates some lm's   Kevin Jorissen
• [Wien] 'stop - follow, nstep > maxfoll' in aim - it's okay now   Kevin Jorissen
• [Wien] Help!   Lo Achd
• [Wien] converting cif   Kirk Feindel
• [Wien] (no subject)   GengHua
• [Wien] Help!   Kevin Jorissen
• [Wien] Re: Jumps in energy   Steven Homolya
• [Wien] Spin-orbital interaction   yanming Ma
• [Wien] Different questions   Gabriela Fernanda Cabeza
• [Wien] problem with supercell   Yaron and Angelica
• [Wien] problem with supercell   Kevin Jorissen
• [Wien] Different questions   Kevin Jorissen
• [Wien] Different questions   Gabriela Fernanda Cabeza
• [Wien] Different questions   Stefaan Cottenier
• [Wien] problem with supercell   Stefaan Cottenier
• [Wien] nHOw to accelerate the caculation?   Li Yonghua
• [Wien] nHOw to accelerate the caculation?   Stefaan Cottenier
• [Wien] Different questions   Peter Blaha
• [Wien] problem with supercell   Stefaan Cottenier
• [Wien] problem with supercell   Yaron and Angelica
• [Wien] Different questions   Gabriela Fernanda Cabeza
• [Wien] system- or usererror?   Michael Frotscher
• [Wien] problem with supercell   Kevin Jorissen
• [Wien] problem with supercell   Yaron and Angelica
• [Wien] Spin-orbital interaction   Lyudmila Dobysheva
• [Wien] help: regarding installation of w2web   Neerja
• [Wien] problem with supercell   Stefaan Cottenier
• [Wien] question   Sergio Galindo Torres
• [Wien] problem with supercell   Yaron and Angelica
• [Wien] warning in sgroup   LAKDJA Abdelaziz
• [Wien] problem with supercell   Stefaan Cottenier
• [Wien] question   Peter Blaha
• [Wien] system- or usererror?   Peter Blaha
• [Wien] problem with supercell   Yaron and Angelica
• [Wien] problem with supercell   Stefaan Cottenier
• [Wien] problem with supercell   Yaron and Angelica
• [Wien] warning in sgroup   B. Yanchitsky
• [Wien] problem with supercell   Stefaan Cottenier
• [Wien] vacuum space in slab calculation   Griselda Garcia
• [Wien] (no subject)   GengHua
• [Wien] Fw:   GengHua
• [Wien] Malaya User   Rashid ahmed
• [Wien] vacuum space in slab calculation   Peter Blaha
• [Wien] MAE; S-O calculation   Claudio Lee
• [Wien] Spin-orbital interaction   yanming Ma
• [Wien] Installation of Intel(R) Fortran Compiler,version 7.1   Mohammed Abujafar
• [Wien] system- or usererror?   Michael Frotscher
• [Wien] vacuum space in slab calculation   Torsten Andersen
• [Wien] Athlon XP optimized BLAS and Lapack libraries available   Jeff Spirko
• [Wien] Athlon XP optimized BLAS and Lapack libraries available   Kirk Feindel
• [Wien] warning in sgroup   LAKDJA Abdelaziz
• [Wien] Can wien2k run on Mac OS X v10?   Ye Zhu
• [Wien] Installation of Intel(R) Fortran Compiler,version 7.1   Stefaan Cottenier
• [Wien] warning in sgroup   B. Yanchitsky
• [Wien] system- or usererror?   Peter Blaha
• [Wien] vacuum space in slab calculation   Griselda Garcia
• [Wien] warning in sgroup   LAKDJA Abdelaziz
• [Wien] Engel-Vosko's GGA   Ruben Weht
• [Wien] Engel-Vosko's GGA   Peter Blaha
• [Wien] MAE; S-O calculation   Peter Blaha
• [Wien] MAE; S-O calculation   Stefaan Cottenier
• [Wien] system- or usererror?   Michael Frotscher
• [Wien] Engel-Vosko's GGA   Ruben Weht
• [Wien] K_{0.3}MoO_{3} unit cell   Lukasz Plucinski
• [Wien] (no subject)   耿华
• [Wien] Athlon XP optimized BLAS and Lapack libraries available   Jeff Spirko
• [Wien] MPI compile error on SGI   music at theory.issp.ac.cn
• [Wien] system- or usererror?   Peter Blaha
• [Wien] nHOw to accelerate the caculation?   Torsten Andersen
• [Wien] nHOw to accelerate the caculation?   Lukasz Plucinski
• [Wien] M/Ge(111)-3x1 reconstruction and mkl_p4   Kevin Jorissen
• [Wien] fermi energy change   yanming Ma
• [Wien] lapw1 error   music at theory.issp.ac.cn
• [Wien] vacuum thickness   翠玉 耿
• [Wien] vacuum thickness   Stefaan Cottenier
• [Wien] nHOw to accelerate the caculation?   Stefaan Cottenier
• [Wien] vacuum thickness   翠玉 耿
• [Wien] still trouble compiling   Michael Frotscher
• [Wien] fermi energy change   lakdja abdelaziz
• [Wien] nHOw to accelerate the caculation?   Peter Blaha
• [Wien] still trouble compiling   Kevin Jorissen
• [Wien] fermi energy change   yanming Ma
• [Wien] fermi energy change   Kevin Jorissen
• [Wien] fermi energy change   yanming Ma
• [Wien] fermi energy change   lakdja abdelaziz
• [Wien] still trouble compiling   Peter Blaha
• [Wien] 回复:[Wien] vacuum thickness   hqk634 at sohu.com
• [Wien] still trouble compiling   Michael Frotscher
• [Wien] adapting qtl-file for 100atoms   Kevin Jorissen
• [Wien] adapting qtl-file for 100atoms   Peter Blaha
• [Wien] about the lapw2c crash   Yushan Wang
• [Wien] Address Errors?   Michael Frotscher
• [Wien] Address Errors?   Stefaan Cottenier
• [Wien] Address Errors?   Lyudmila Dobysheva
• [Wien] Address Errors?   Michael Frotscher
• [Wien] Address Errors?   Stefaan Cottenier
• [Wien] Relaxation (mini) problem   Lukasz Plucinski
• [Wien] FSGEN   Peter Blaha
• [Wien] FSGEN   Shen Li Qiu
• [Wien] Relaxation (mini) problem   Peter Blaha
• [Wien] Compile with PGF90 on RedHat 9.0--"subprogram too large to compile at this optimization level"   Matthew.Carey at hgst.com
• [Wien] Compile with PGF90 on RedHat 9.0--"subprogram too large to compile at this optimization level"   Kirk Feindel
• [Wien] Address Errors?   Michael Frotscher
• [Wien] Address Errors?   Stefaan Cottenier
• [Wien] Address Errors?   Michael Frotscher
• [Wien] band structure of Ge in the zinc blende structure   mokhtari
• [Wien] band structure of Ge in the zinc blende structure   zoulikha charifi
• [Wien] optimize for cubic materials   Natalie Holzwarth
• [Wien] lapw1.error?   aj6 at njit.edu
• [Wien] lapw1.error?   Stefaan Cottenier
• [Wien] optimize for cubic materials   Jorissen Kevin
• [Wien] band structure of Ge in the zinc blende structure   Fred Nastos
• [Wien] Compile with PGF90 on RedHat 9.0--"subprogram too large to compile at this optimization level"   Matthew.Carey at hgst.com
• [Wien] RMT parameter   Dr. B.R.Sahu
• [Wien] 回复:[Wien] vacuum thickness   hqk634 at sohu.com
• [Wien] RMT parameter   Peter Blaha
• [Wien] Address Errors?   Peter Blaha
• [Wien] RMT parameter   Stefaan Cottenier
• [Wien] RMT parameter   Peter Blaha
• [Wien] inconsistency between lapw1 and mini?   Veerle Vanhoof
• [Wien] Address Errors?   Michael Frotscher
• [Wien] Address Errors?   Michael Frotscher
• [Wien] lapw2 crashed   music at theory.issp.ac.cn
• [Wien] increase of number of k-points   Lyudmila Dobysheva
• [Wien] inconsistency between lapw1 and mini?   Peter Blaha
• [Wien] any user of WIEN in Malaysia   SOHAIL AFZAL

Last message date: Thu Jul 31 20:15:49 CEST 2003
Archived on: Wed Jul 6 14:14:06 CEST 2005

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