wien
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2011/02/17
[Wien] Counting the numer of electrons / slightly metallic tail crossing EF
Hua Wu
2011/02/17
[Wien] Counting the numer of electrons / slightly metallic tail crossing EF
Son Won-joon
2011/02/16
[Wien] Interstitial hybridization
Pavel Novak
2011/02/16
[Wien] installing linux in icore3 systems
Ramkumar Thapa
2011/02/16
[Wien] installing linux in icore3 systems
Dr Qi Wen YAO
2011/02/16
[Wien] Interstitial hybridization
Andres E Becerra-Toledo
2011/02/16
[Wien] installing linux in icore3 systems
Laurence Marks
2011/02/16
[Wien] installing linux in icore3 systems
Ramkumar Thapa
2011/02/16
[Wien] [Q] Counting the numer of electrons / slight metallic states
Son Won-joon
2011/02/16
[Wien] how to read the format of case.energy files
Volodymyr Svitlyk
2011/02/15
[Wien] HI
Rajagopalan Mathrubutham
2011/02/14
[Wien] HI
Peter Blaha
2011/02/14
[Wien] HI
Rajagopalan Mathrubutham
2011/02/14
[Wien] Wien2k 10 with Gnuplot 4.4.0
viel...@onid.orst.edu
2011/02/11
[Wien] Phonon difficulties
Peter Blaha
2011/02/11
[Wien] Phonon difficulties
Ghosh SUDDHASATTWA
2011/02/11
[Wien] Phonon difficulties
pu...@iitk.ac.in
2011/02/10
[Wien] L2main - Error
Niloofar Zarifi
2011/02/10
[Wien] Suggestions on PHONON Calculation 4
Ghosh SUDDHASATTWA
2011/02/10
[Wien] Suggestions on PHONON Calculation 4
Peter Blaha
2011/02/10
[Wien] Suggestions on PHONON Calculation 4
Ghosh SUDDHASATTWA
2011/02/10
[Wien] About FS plotting
Artamonov Oleg
2011/02/10
[Wien] cholesky INFO error in Mn doped Bi supercell calculation
Rocquefelte
2011/02/10
[Wien] cholesky INFO error in Mn doped Bi supercell calculation
Stefaan Cottenier
2011/02/10
[Wien] cholesky INFO error in Mn doped Bi supercell calculation
shamik chakrabarti
2011/02/09
[Wien] cholesky INFO error in Mn doped Bi supercell calculation
Laurence Marks
2011/02/09
[Wien] cholesky INFO error in Mn doped Bi supercell calculation
shamik chakrabarti
2011/02/09
[Wien] optimize.job script for mBJ functional
pascal boulet
2011/02/08
[Wien] optimize.job script for mBJ functional
Peter Blaha
2011/02/08
[Wien] optimize.job script for mBJ functional
Francisco Garcia
2011/02/07
[Wien] About FS plotting
Peter Blaha
2011/02/07
[Wien] About FS plotting
Artamonov Oleg
2011/02/06
[Wien] lapw0_mpi hangs
Markus Kaukonen
2011/02/05
[Wien] Fwd: an doubt in the analysis of Density of States
Gerhard Fecher
2011/02/04
[Wien] Fwd: an doubt in the analysis of Density of States
shamik chakrabarti
2011/02/04
[Wien] inclusion of LYBP or any in exchange correlation for biological systems
t...@theochem.tuwien.ac.at
2011/02/04
[Wien] inclusion of LYBP or any in exchange correlation for biological systems
physics phys
2011/02/03
[Wien] Suggestions on PHONON Calculations 3
Peter Blaha
2011/02/02
[Wien] Suggestions on PHONON Calculations 3
Ghosh SUDDHASATTWA
2011/02/01
[Wien] local rotation matrix in QTL program
Masao ARAI
2011/01/31
[Wien] an doubt in the analysis of Density of States
shamik chakrabarti
2011/01/31
[Wien] lapw0_mpi hangs
Peter Blaha
2011/01/31
[Wien] lapw0_mpi hangs
Laurence Marks
2011/01/31
[Wien] lapw0_mpi hangs
Markus Kaukonen
2011/01/29
[Wien] spin-orbit calculation with mbj
t...@theochem.tuwien.ac.at
2011/01/29
[Wien] spin-orbit calculation with mbj
Francisco Garcia
2011/01/27
[Wien] Identification of Non-Equivalent Atoms in Hellmann-Feynman Force File
Ghosh SUDDHASATTWA
2011/01/27
[Wien] Identification of Non-Equivalent Atoms in Hellmann-Feynman Force File
Peter Blaha
2011/01/27
[Wien] Identification of Non-Equivalent Atoms in Hellmann-Feynman Force File
Ghosh SUDDHASATTWA
2011/01/26
[Wien] coordinate system
Peter Blaha
2011/01/25
[Wien] c/a optimization error
pu...@iitk.ac.in
2011/01/25
[Wien] Segmentation fault
Peter Blaha
2011/01/25
[Wien] coordinate system
YONGBIN LEE
2011/01/24
[Wien] How to get WIEN2PHON code?
Peter Blaha
2011/01/24
[Wien] How to get WIEN2PHON code?
Ghosh SUDDHASATTWA
2011/01/24
[Wien] Suggestions on Hellmann-Feynman File: Forces (2)
Ghosh SUDDHASATTWA
2011/01/24
[Wien] Segmentation fault
andyalex
2011/01/24
[Wien] How to get WIEN2PHON code?
Kiseok Chang
2011/01/23
[Wien] coordinate system
Peter Blaha
2011/01/23
[Wien] fermi surface including spin-orbital interaction
Jian-Xin Zhu
2011/01/23
[Wien] fermi surface including spin-orbital interaction
liujuan...@sina.com
2011/01/22
[Wien] coordinate system
YONGBIN LEE
2011/01/21
[Wien] WARNING : Please restart anew from final position
Kakhaber Jandieri
2011/01/21
[Wien] WARNING : Please restart anew from final position
Laurence Marks
2011/01/21
[Wien] WARNING : Please restart anew from final position
Kakhaber Jandieri
2011/01/20
[Wien] WARNING : Please restart anew from final position
Laurence Marks
2011/01/20
[Wien] WARNING : Please restart anew from final position
Kakhaber Jandieri
2011/01/20
[Wien] Suggestions on the Hellmann-Feynman Force File: analyse_phonon_lapw
Ghosh SUDDHASATTWA
2011/01/20
[Wien] Suggestions on the Hellmann-Feynman Force File : analyse_phonon_lapw
Peter Blaha
2011/01/19
[Wien] Suggestions on the Hellmann-Feynman Force File : analyse_phonon_lapw
Ghosh SUDDHASATTWA
2011/01/19
[Wien] problem with running TB-MBJ for band gaps.
Peter Blaha
2011/01/19
[Wien] problem with running TB-MBJ for band gaps.
yedu kondalu
2011/01/19
[Wien] MPI problems
Laurence Marks
2011/01/18
[Wien] MPI problems
Laurent CHAPUT
2011/01/18
[Wien] problem with lapw2para
Peter Blaha
2011/01/17
[Wien] problem with lapw2para
Aboudi Hamouda
2011/01/16
[Wien] How to calculate the magnetization in momentum space
Robert Laskowski
2011/01/16
[Wien] How to calculate the magnetization in momentum space
Saeed Bahramy
2011/01/16
[Wien] How to calculate the magnetization in momentum space
Robert Laskowski
2011/01/16
[Wien] How to calculate the magnetization in momentum space
Saeed Bahramy
2011/01/16
[Wien] How to calculate the magnetization in momentum space
Robert Laskowski
2011/01/15
[Wien] Problem Related to bandstructure
Gerhard Fecher
2011/01/15
[Wien] How to calculate the magnetization in momentum space
Saeed Bahramy
2011/01/15
[Wien] Problem Related to bandstructure
Laurence Marks
2011/01/15
[Wien] Problem Related to bandstructure
SANJAY KUMAR SINGH
2011/01/14
[Wien] PHONON calculation
Ghosh SUDDHASATTWA
2011/01/14
[Wien] PHONON calculation
pu...@iitk.ac.in
2011/01/13
[Wien] Wien2k with GNU and OPENMPI
Aboudi Hamouda
2011/01/13
[Wien] Plotting probability density of QWS
Peter Blaha
2011/01/13
[Wien] Plotting probability density of QWS
Bartosz Slomski
2011/01/11
[Wien] parallel
Laurence Marks
2011/01/11
[Wien] parallel
lagoun brahim
2011/01/11
[Wien] PHONON calculation
Peter Blaha
2011/01/11
[Wien] PHONON calculation
pu...@iitk.ac.in
2011/01/11
[Wien] parallel
Peter Blaha
2011/01/11
[Wien] parallel
lagoun brahim
2011/01/11
[Wien] (no subject)
lagoun brahim
2011/01/11
[Wien] Bloch state coefficient
Aboudi Hamouda
2011/01/11
[Wien] Plotting probability density of QWS
Bartosz Slomski
2011/01/10
[Wien] PHONON calculation
Ghosh SUDDHASATTWA
2011/01/10
[Wien] PHONON calculation
pu...@iitk.ac.in
2011/01/10
[Wien] patent
Jihoon Park
2011/01/09
[Wien] Problems in phonon calculations (4)
Ghosh SUDDHASATTWA
2011/01/09
[Wien] Question about mBJ calculation
David
2011/01/09
[Wien] Question about mBJ calculation
t...@theochem.tuwien.ac.at
2011/01/09
[Wien] Question about mBJ calculation
David
2011/01/09
[Wien] charge density plots
hazem salem
2011/01/09
[Wien] Question about mBJ calculation
Peter Blaha
2011/01/08
[Wien] Question about mBJ calculation
David
2011/01/08
[Wien] Problems in phonon calculations (3)
Peter Blaha
2011/01/07
[Wien] Problems in phonon calculations (3)
Ghosh SUDDHASATTWA
2011/01/07
[Wien] about x lapw1 -nmat_only (3)
Peter Blaha
2011/01/07
[Wien] error lapw2
van...@urisan.tche.br
2011/01/07
[Wien] about x lapw1 -nmat_only (3)
Aboudi Hamouda
2011/01/07
[Wien] Compilling error - for latest Ubuntu, Ifort/MKL
Dr Qi Wen YAO
2011/01/07
[Wien] error lapw0
Tomas Kana
2011/01/06
[Wien] Compilling error - for latest Ubuntu, Ifort/MKL
Dr Qi Wen YAO
2011/01/05
[Wien] Changing RKmax 7.00 to 8.00 during phonon calculations
Ghosh SUDDHASATTWA
2011/01/05
[Wien] Error while running run_phonon PROBLEM SOLVED
Ghosh SUDDHASATTWA
2011/01/05
[Wien] Error while running run_phonon
Ghosh SUDDHASATTWA
2011/01/05
[Wien] about x lapw1 -nmat_only (3)
Aboudi Hamouda
2011/01/05
[Wien] [SPAM?] Re: about x lapw1 -nmat_only (2)
Peter Blaha
2011/01/05
[Wien] error lapw0
van...@urisan.tche.br
2011/01/05
[Wien] about x lapw1 -nmat_only (2)
Aboudi Hamouda
2011/01/05
[Wien] about x lapw1 -nmat_only
Peter Blaha
2011/01/05
[Wien] about x lapw1 -nmat_only
Aboudi Hamouda
2011/01/04
[Wien] Error in LAPW1 'Unknow' - SIGSEGV, contact developers
Laurence Marks
2011/01/04
[Wien] Error in LAPW1 'Unknow' - SIGSEGV, contact developers
Markus Kaukonen
2011/01/04
[Wien] Using the -in1ef switch for phonon calculations
Ghosh SUDDHASATTWA
2011/01/04
[Wien] Error in LAPW1 'Unknow' - SIGSEGV, contact developers
Laurence Marks
2011/01/04
[Wien] Using the -in1ef switch for phonon calculations
pu...@iitk.ac.in
2011/01/04
[Wien] Using the -in1ef switch for phonon calculations
Ghosh SUDDHASATTWA
2011/01/04
[Wien] Error while running run_phonon
Ghosh SUDDHASATTWA
2011/01/04
[Wien] Error in LAPW1 'Unknow' - SIGSEGV, contact developers
Markus Kaukonen
2011/01/03
[Wien] Problem in run_phonon script
Ghosh SUDDHASATTWA
2011/01/03
[Wien] Problem in run_phonon script
Peter Blaha
2011/01/03
[Wien] Problem in run_phonon script
Ghosh SUDDHASATTWA
2011/01/03
[Wien] Ti HCP
Tomas Kana
2011/01/03
[Wien] Ti HCP
van...@urisan.tche.br
2011/01/03
[Wien] Convergence criteria for phonon calculations
Ghosh SUDDHASATTWA
2011/01/03
[Wien] Problem in run_phonon script
Ghosh SUDDHASATTWA
2011/01/02
[Wien] Problem in run_phonon script
Gerhard Fecher
2011/01/02
[Wien] Problem in run_phonon script
Ghosh SUDDHASATTWA
2011/01/02
[Wien] Help required in analysis of BS
Peter Blaha
2011/01/02
[Wien] Modifications in phonon script
Peter Blaha
2010/12/31
[Wien] Help required in analysis of BS
Subhra Kulshrestha
2010/12/31
[Wien] Modifications in phonon script
Ghosh SUDDHASATTWA
2010/12/30
[Wien] Suggestions on case.d45 file and command line options
Ghosh SUDDHASATTWA
2010/12/30
[Wien] Suggestions on case.d45 file and command line options
Ghosh SUDDHASATTWA
2010/12/30
[Wien] Suggestions on case.d45 file and command line options
Ghosh SUDDHASATTWA
2010/12/30
[Wien] Suggestions on case.d45 file and command line options
Gerhard Fecher
2010/12/30
[Wien] Suggestions on case.d45 file and command line options
Ghosh SUDDHASATTWA
2010/12/30
[Wien] Wien2k install compiling error?
lucking-pine
2010/12/30
[Wien] Wien2k install compiling error?
Laurence Marks
2010/12/30
[Wien] Wien2k install compiling error?
lucking-pine
2010/12/30
[Wien] SDW calculation
pu...@iitk.ac.in
2010/12/28
[Wien] Suggestions on case.d45 file and command line options
Ghosh SUDDHASATTWA
2010/12/27
[Wien] Suggestions on case.d45 file and command line options
Ghosh SUDDHASATTWA
2010/12/26
[Wien] Wien2k install compiling error?
lucking-pine
2010/12/25
[Wien] Wien2k install compiling error?
Peter Blaha
2010/12/25
[Wien] Wien2k install compiling error?
lucking-pine
2010/12/25
[Wien] About the geometry optimization
Laurence Marks
2010/12/25
[Wien] About the geometry optimization
yhzhao
2010/12/24
[Wien] Wien2k install compiling error?
Wei Xie
2010/12/24
[Wien] Wien2k install compiling error?
改王之王改王之王
2010/12/24
[Wien] Wien2k install compiling error?
Peter Blaha
2010/12/24
[Wien] Wien2k install compiling error?
改王之王改王之王
2010/12/23
[Wien] k point parallel in a supercomputer that returns a single name for .machines file
Markus Kaukonen
2010/12/23
[Wien] k point parallel in a supercomputer that returns a single name for .machines file
Peter Blaha
2010/12/23
[Wien] k point parallel in a supercomputer that returns a single name for .machines file
Markus Kaukonen
2010/12/23
[Wien] k point parallel in a supercomputer that returns a single name for .machines file
Peter Blaha
2010/12/23
[Wien] k point parallel in a supercomputer that returns a single name for .machines file
Markus Kaukonen
2010/12/23
[Wien] k point parallel in a supercomputer that returns a single name for .machines file
Peter Blaha
2010/12/23
[Wien] hi
NORIZA Ahmad Zabidi
2010/12/22
[Wien] 2011 edition of the conference "The New Generation in Strongly Correlated Electron Systems"
Victor Pardo Castro
2010/12/21
[Wien] k point parallel in a supercomputer that returns a single name for .machines file
Markus Kaukonen
2010/12/21
[Wien] translation vector
Tomas Kana
2010/12/20
[Wien] translation vector
marziye foroughpour
2010/12/16
[Wien] LAPW0 hangs in mBJ calculation
John McLeod
2010/12/16
[Wien] Problem_mBJLDA_error with PRATT
Manish Kumar
2010/12/16
[Wien] for the second time problem with w2web"Error - Failed to open file"
yasir saeed
2010/12/16
[Wien] sum of eigenvalue
Bin Shao
2010/12/16
[Wien] Importing Bandstructure plot in Matlab
Ghosh SUDDHASATTWA
2010/12/16
[Wien] for the second time problem with w2web"Error - Failed to open file"
Tomas Kana
2010/12/16
[Wien] optimize for tetragonal lattice
Peter Blaha
2010/12/16
[Wien] LAPW0 hangs in mBJ calculation
Peter Blaha
2010/12/16
[Wien] sum of eigenvalue
Peter Blaha
2010/12/16
[Wien] optimize for tetragonal lattice
shiyaojun
2010/12/16
[Wien] Segmentation fault occured
Maxim Rakitin
2010/12/16
[Wien] Segmentation fault occured
msoum...@physics.auth.gr
2010/12/15
[Wien] sum of eigenvalue
Bin Shao
2010/12/15
[Wien] sum of eigenvalue
Peter Blaha
2010/12/15
[Wien] Problem_mBJLDA_error
Peter Blaha
2010/12/15
[Wien] Problem_mBJLDA_error
Manish Kumar
2010/12/15
[Wien] sum of eigenvalue
Bin Shao
2010/12/15
[Wien] for the second time problem with w2web"Error - Failed to open file"
sufyan
2010/12/15
[Wien] for the second time problem with w2web"Error - Failed to open file"
Tomas Kana
2010/12/15
[Wien] for the second time problem with w2web"Error - Failed to open file"
sufyan
2010/12/15
[Wien] LAPW0 hangs in mBJ calculation
John McLeod
2010/12/14
[Wien] Born effective charge
santu baidya
Earlier messages
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