June 2011 Archives by author

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Starting: Wed Jun 1 09:30:00 CEST 2011
Ending: Thu Jun 30 20:34:58 CEST 2011
Messages: 170

• [Wien] Plane-wave cutoff in W2K   Marcos Veríssimo Alves
• [Wien] Plane-wave cutoff in W2K   Marcos Veríssimo Alves
• [Wien] optical properties   SHAMEEM BANU
• [Wien] How do I set monoclinic angle beta to monoclinic angle gama   Chandra Bhanu Basak
• [Wien] Units of k-vectors in the case.spaghetti_ene file   Moritz Binder
• [Wien] bug for spaghetti for monoclinic CXZ lattices AND spin-orbit   Peter Blaha
• [Wien] new optimization scheme   Peter Blaha
• [Wien] Compilation problems on Red Hat 4 with gfortran and gotolib   Peter Blaha
• [Wien] Compilation problems on Red Hat 4 with G95/gfortran and gotolib   Peter Blaha
• [Wien] new optimization scheme   Peter Blaha
• [Wien] Magnetic properties or 5d metals   Peter Blaha
• [Wien] error during DOS calculation   Peter Blaha
• [Wien] error during DOS calculation   Peter Blaha
• [Wien] A question regarding a calculation for a 56 atoms unit cell   Peter Blaha
• [Wien] A question regarding a calculation for a 56 atoms unit cell   Peter Blaha
• [Wien] Plane-wave cutoff in W2K   Peter Blaha
• [Wien] pondering wien2kMPI performance   Peter Blaha
• [Wien] GGA-EV   Peter Blaha
• [Wien] a perpetual request of the password   Peter Blaha
• [Wien] a perpetual request of the password   Peter Blaha
• [Wien] K-point parallel with MPI   Peter Blaha
• [Wien] About optic code in WIEN2k_11.1 (Release 5/4/2011)   Peter Blaha
• [Wien] K-point parallel with MPI   Peter Blaha
• [Wien] '12main' - QTL-B.GT.15., Ghostbands, check scf files   Peter Blaha
• [Wien] Boltztrap   Peter Blaha
• [Wien] w2web in version 11   Peter Blaha
• [Wien] dstart   Peter Blaha
• [Wien] problem pending   Peter Blaha
• [Wien] Help with Operation System   Peter Blaha
• [Wien] "R0 too large"----"SELECT - Error"   Peter Blaha
• [Wien] Help with Operation System   Peter Blaha
• [Wien] Units of k-vectors in the case.spaghetti_ene file   Peter Blaha
• [Wien] A problem in running SCF   Peter Blaha
• [Wien] optical properties   Peter Blaha
• [Wien] error lstart.def failed   Peter Blaha
• [Wien] negative position in rstruc.   Peter Blaha
• [Wien] negative position in rstruc.   Peter Blaha
• [Wien] e-field in lapw0   Peter Blaha
• [Wien] pabdelrahim at gmail.com   Peter Blaha
• [Wien] transition probabilities   Peter Blaha
• [Wien] A question regarding a calculation for a 56 atoms unit cell   Shamik Chakrabarti
• [Wien] About optic code in WIEN2k_11.1 (Release 5/4/2011)   Dr. Sharat Chandra
• [Wien] About optic code in WIEN2k_11.1 (Release 5/4/2011)   Sharat Chandra
• [Wien] Volume optimization and Struct File   Judy Cherian
• [Wien] Volume optimization and Struct File   Stefaan Cottenier
• [Wien] lapw2   Stefaan Cottenier
• [Wien] Where is Orbital moment?   Stefaan Cottenier
• [Wien] Magnetic material relaxation, RMT, MAE calculations   Stefaan Cottenier
• [Wien] lapw2   Stefaan Cottenier
• [Wien] rare bug in init_lapw   Stefaan Cottenier
• [Wien] new optimization scheme   Lyudmila V. Dobysheva
• [Wien] new optimization scheme   Lyudmila V. Dobysheva
• [Wien] error during compilation (siteconfig_lapw)   Gerhard Fecher
• [Wien] LAPW2 problem   Gerhard Fecher
• [Wien] Magnetic material relaxation, RMT, MAE calculations   Gerhard Fecher
• [Wien] updating to wien2k_11   Gerhard Fecher
• [Wien] error during DOS calculation   Gerhard Fecher
• [Wien] compilation aborted for lap_bp.f (code 1)   Gerhard Fecher
• [Wien] GGA-EV   Gerhard Fecher
• [Wien] error: command /root/wien2k/lstart lstart.def failed   Gerhard Fecher
• [Wien] mini error   Gerhard Fecher
• [Wien] graphene   Martin Gmitra
• [Wien] graphene   Martin Gmitra
• [Wien] difference in forces from mini and scf calculations   Seyed Javad Hashemifar
• [Wien] difference in forces from mini and scf calculations   Md. Fhokrul Islam
• [Wien] difference in forces from mini and scf calculations   Md. Fhokrul Islam
• [Wien] difference in forces from mini and scf calculations   Md. Fhokrul Islam
• [Wien] pondering wien2kMPI performance   Kevin Jorissen
• [Wien] Help with Operation System   M. Koshino
• [Wien] Help with Operation System   M. Koshino
• [Wien] pondering wien2kMPI performance   Robert Laskowski
• [Wien] graphene   Robert Laskowski
• [Wien] tran. prob.   Robert Laskowski
• [Wien] graphene   Robert Laskowski
• [Wien] Compilation problems on Red Hat 4 with G95/gfortran and gotolib   Laurence Marks
• [Wien] new optimization scheme   Laurence Marks
• [Wien] new optimization scheme   Laurence Marks
• [Wien] Warning in lapw1   Laurence Marks
• [Wien] lapw2   Laurence Marks
• [Wien] a perpetual request of the password   Laurence Marks
• [Wien] difference in forces from mini and scf calculations   Laurence Marks
• [Wien] dstart   Jose Alfredo Camargo Martinez
• [Wien] "R0 too large"----"SELECT - Error"   MingWenmei
• [Wien] Magnetic properties or 5d metals   Pablo de la Mora
• [Wien] Magnetic properties or 5d metals   Pablo de la Mora
• [Wien] Compilation problems on Red Hat 4 with G95/gfortran and gotolib   Osbaldeston, Ryan
• [Wien] Compilation problems on Red Hat 4 with gfortran and gotolib   Osbaldeston, Ryan
• [Wien] Compilation problems on Red Hat 4 with G95/gfortran and gotolib   Osbaldeston, Ryan
• [Wien] MAE calculation   Jihoon Park
• [Wien] Where is Orbital moment?   Jihoon Park
• [Wien] Magnetic material relaxation, RMT, MAE calculations   Jihoon Park
• [Wien] Magnetic material relaxation, RMT, MAE calculations   Jihoon Park
• [Wien] Force theorem for MAE   Jihoon Park
• [Wien] '12main' - QTL-B.GT.15., Ghostbands, check scf files   Jihoon Park
• [Wien] force theorem   Jihoon Park
• [Wien] Error an Electron Density Plots   M. Mahendran (Assoc Prof)
• [Wien] pabdelrahim at gmail.com   Patricia Abdel Rahim
• [Wien] problem during visualisation supercell structure   Pooja Rana
• [Wien] problem pending   Pooja Rana
• [Wien] How do I set monoclinic angle beta to monoclinic angle gama   Ghosh SUDDHASATTWA
• [Wien] mini error   Ghosh SUDDHASATTWA
• [Wien] No lines in spaghetti   Sanjeev K. Srivastava
• [Wien] No lines in spaghetti   Sanjeev K. Srivastava
• [Wien] graphene   Zahra Talebi
• [Wien] graphene   Zahra Talebi
• [Wien] graphene   Zahra Talebi
• [Wien] graphene   Zahra Talebi
• [Wien] graphene   Zahra Talebi
• [Wien] graphene   Zahra Talebi
• [Wien] compilation aborted for lap_bp.f (code 1)   Ramkumar Thapa
• [Wien] Boltztrap   Ramkumar Thapa
• [Wien] tran. prob.   Ramkumar Thapa
• [Wien] transition probabilities   Ramkumar Thapa
• [Wien] Warning in lapw1   David Tompsett
• [Wien] K-point parallel with MPI   David Tompsett
• [Wien] LAPW2 problem   AJAY SINGH VERMA
• [Wien] LAPW2 problem   AJAY SINGH VERMA
• [Wien] GGA-EV   AJAY SINGH VERMA
• [Wien] e-field in lapw0   Torsten Weissbach
• [Wien] optical properties   shameem banu
• [Wien] bandstructure plot of AFMII NiO   bruce.tian
• [Wien] error lstart.def failed   bs bs
• [Wien] error: command /root/wien2k/lstart lstart.def failed   bs bs
• [Wien] error: command /root/wien2k/lstart lstart.def failed   bs bs
• [Wien] How do I set monoclinic angle beta to monoclinic angle gama   bs bs
• [Wien] error during compilation (siteconfig_lapw)   shamik chakrabarti
• [Wien] error during DOS calculation   shamik chakrabarti
• [Wien] error during DOS calculation   shamik chakrabarti
• [Wien] A question regarding a calculation for a 56 atoms unit cell   shamik chakrabarti
• [Wien] A question regarding a calculation for a 56 atoms unit cell   shamik chakrabarti
• [Wien] error during DOS calculation   shamik chakrabarti
• [Wien] compilation aborted for lap_bp.f (code 1)   shamik chakrabarti
• [Wien] Two questions regarding volume optimization   shamik chakrabarti
• [Wien] Two questions regarding volume optimization   shamik chakrabarti
• [Wien] problem during visualisation supercell structure   shamik chakrabarti
• [Wien] lapw1 running   larbi elfarh
• [Wien] transition probabilities   grad at famaf.unc.edu.ar
• [Wien] Why dielectric function differs by 1 ?   gbliu
• [Wien] GGA-EV   sudhir kumar
• [Wien] error In source file qmix7.F   mouhamed mahdi
• [Wien] updating to wien2k_11   mouhamed mahdi
• [Wien] Fwd: A problem in running SCF   majid moazamiii
• [Wien] Fwd: A problem in running SCF   majid moazamiii
• [Wien] A problem in running SCF   leila moazzami
• [Wien] Optimize Error   TUX naughty
• [Wien] mBJ potential   TUX naughty
• [Wien] problem during visualisation supercell structure   yasir saeed
• [Wien] regarding plasma frequency of semi conductor and insulator   yasir saeed
• [Wien] regarding plasma frequency of semi conductor and insulator   yasir saeed
• [Wien] Boltztrap   hazem salem
• [Wien] x symmetry   shiyaojun
• [Wien] GGA-EV   tran at theochem.tuwien.ac.at
• [Wien] GGA-EV   tran at theochem.tuwien.ac.at
• [Wien] mBJ potential   tran at theochem.tuwien.ac.at
• [Wien] how to configure my .machine file   Karen tim
• [Wien] a perpetual request of the password   Karen tim
• [Wien] I want to calculate stoner parameter   crispulo enrique deluque toro
• [Wien] K-point parallel with MPI   moshi uddin
• [Wien] K-point parallel with MPI   moshi uddin
• [Wien] DOS   vandao at urisan.tche.br
• [Wien] lapw2   vandao at urisan.tche.br
• [Wien] lapw2   vandao at urisan.tche.br
• [Wien] dstart   vandao at urisan.tche.br
• [Wien] dstart   vandao at urisan.tche.br
• [Wien] Help with Operation System   vandao at urisan.tche.br
• [Wien] problemans with w2web and libmkl_intel_lp64.so   vandao at urisan.tche.br
• [Wien] Installation of Phonon511   jianguang wang
• [Wien] problem with lapw2   水牧 仁一朗
• [Wien] negative position in rstruc.   水牧 仁一朗
• [Wien] negative position in rstruc.   水牧 仁一朗

Last message date: Thu Jun 30 20:34:58 CEST 2011
Archived on: Thu Jun 30 20:35:15 CEST 2011

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