March 2012 Archives by subject
Starting: Thu Mar 1 08:19:04 CET 2012
Ending: Fri Mar 30 17:27:02 CEST 2012
Messages: 208
- [Wien] "stop core end" Kindly help .Not able to find optical property
Masood Yousaf
- [Wien] 'Plane waves exhasted' error
Hiroshi Nakano
- [Wien] 'Plane waves exhasted' error
M. Koshino
- [Wien] 'Plane waves exhasted' error
Fecher, Gerhard
- [Wien] 'Plane waves exhasted' error
Laurence Marks
- [Wien] (no subject)
Zahia Aboub
- [Wien] (no subject)
Zahia Aboub
- [Wien] (no subject)
Saba Sabeti
- [Wien] (no subject)
Zahia Aboub
- [Wien] 3D spin density
kangbugy at lycos.co.kr
- [Wien] 3D spin density
Peter Blaha
- [Wien] [SPAM?] problem to compile
luca sementa
- [Wien] [SPAM?] unit in output spectra of TELNES3
ZhenChen
- [Wien] A question regarding magnetic/spin calculation in Wien2k please
Fecher, Gerhard
- [Wien] A question regarding magnetic/spin calculation in Wien2k please
Qiwen YAO
- [Wien] A question regarding magnetic/spin calculation in Wien2k please
Laurence Marks
- [Wien] A question regarding magnetic/spin calculation in Wien2k please
Qiwen YAO
- [Wien] A question regarding magnetic/spin calculation in Wien2k please
Rocquefelte
- [Wien] another criteria for the option 6 of the optimization
sufyan
- [Wien] B_lat hyperfine field NMR
David Tompsett
- [Wien] B_lat hyperfine field NMR
Stefaan Cottenier
- [Wien] bandstructure error( with spin-orbit interaction )
L
- [Wien] bandstructure error( with spin-orbit interaction )
Peter Blaha
- [Wien] Boltztrap
ali ghafari
- [Wien] Charge analysis
bruce.tian
- [Wien] Charge analysis
Laurence Marks
- [Wien] chemical bonding
Yundi Quan
- [Wien] chemical bonding
Laurence Marks
- [Wien] chemical bonding
Yundi Quan
- [Wien] chemical bonding
Laurence Marks
- [Wien] chemical bonding
Rocquefelte
- [Wien] chemical bonding
Yundi Quan
- [Wien] chemical bonding
Rocquefelte
- [Wien] compilation problem for the installation of wien2k
Laurence Marks
- [Wien] converting *.struct format to another format
mohaddeseh abbasnejad
- [Wien] converting *.struct format to another format
Parker, David S.
- [Wien] converting *.struct format to another format
mohaddeseh abbasnejad
- [Wien] Core separation energy & RMT, please let us know the values
泉 康雄
- [Wien] Core separation energy & RMT, please let us know the values
Rocquefelte
- [Wien] Core separation energy & RMT, please let us know the values
泉 康雄
- [Wien] Core separation energy & RMT, please let us know the values
Rocquefelte
- [Wien] Core separation energy & RMT, please let us know the values
Stefaan Cottenier
- [Wien] dstart
ben amara imen
- [Wien] dstart
Laurence Marks
- [Wien] DSTART
Antônio Vanbderlei dos Santos
- [Wien] EF not accurate
Zahia Aboub
- [Wien] EF not accurate
Lyudmila Dobysheva
- [Wien] Emax in "case.in1" within spin-orbit coupling calculations
hyunjung kim
- [Wien] Emax in case.in1 within spin-orbit coupling calculations
hyunjung kim
- [Wien] Emax in case.in1 within spin-orbit coupling calculations
Stefaan Cottenier
- [Wien] error in lapw1
Swetarekha Ram
- [Wien] Error in LAPW1
Antônio Vanbderlei dos Santos
- [Wien] Error in LAPW1
Laurence Marks
- [Wien] Error in LAPW1
Stefaan Cottenier
- [Wien] Error in LAPW1
Antônio Vanbderlei dos Santos
- [Wien] error in spin-orbit coupling
Madhav Ghimire
- [Wien] error in spin-orbit coupling
Peter Blaha
- [Wien] error in spin-orbit coupling
Peter Blaha
- [Wien] error in spin-orbit coupling
Madhav Ghimire
- [Wien] exciton trapping
Fabiana Da Pieve
- [Wien] exciton trapping
Laurence Marks
- [Wien] exciton trapping
Fabiana Da Pieve
- [Wien] external potential inside the muffin-tin sphere
Yundi Quan
- [Wien] external potential inside the muffin-tin sphere
Nazma Ikram
- [Wien] external potential inside the muffin-tin sphere
Laurence Marks
- [Wien] external potential inside the muffin-tin sphere
Yundi Quan
- [Wien] external potential inside the muffin-tin sphere
Rocquefelte
- [Wien] external potential inside the muffin-tin sphere
Yundi Quan
- [Wien] external potential inside the muffin-tin sphere
Rocquefelte
- [Wien] Fermi surface by using, XCrySDen
علاء عبد الحميد
- [Wien] Fermi surface by using, XCrySDen
Gavin Abo
- [Wien] Fermi surface by XCrySDen
علاء عبد الحميد
- [Wien] gmin
Yundi Quan
- [Wien] Help of Fermi Surface
Alex Animalu
- [Wien] Help of Fermi Surface
Gregory Pomrehn
- [Wien] Help of Fermi Surface
Peter Blaha
- [Wien] Help on Fermi Surface Plotting
Alex Animalu
- [Wien] help required
arqum hashmi
- [Wien] help required
Laurence Marks
- [Wien] help required
arqum hashmi
- [Wien] help required
arqum hashmi
- [Wien] help required
Peter Blaha
- [Wien] help required
arqum hashmi
- [Wien] help required
Stefaan Cottenier
- [Wien] help required
arqum hashmi
- [Wien] help required
Stefaan Cottenier
- [Wien] help required
arqum hashmi
- [Wien] help required
arqum hashmi
- [Wien] help required
Stefaan Cottenier
- [Wien] help required
MOWAFAQ MOHAMMAD KETHYAN AL-SARDIA
- [Wien] help required
Laurence Marks
- [Wien] help required
Stefaan Cottenier
- [Wien] how to choose the plane for plotting Electron Density without XCRYSDEN
Zhou Bing
- [Wien] how to choose the plane for plotting Electron Density without XCRYSDEN
Rocquefelte
- [Wien] how to choose the plane for plotting Electron Density without XCRYSDEN
Zhou Bing
- [Wien] how to obtain the result of (px+py)/2-pz
Zhou Bing
- [Wien] Invitation to connect on LinkedIn
Kiseok Chang via LinkedIn
- [Wien] Invitation to connect on LinkedIn
jaafar jalilian via LinkedIn
- [Wien] Lapw1
Laurence Marks
- [Wien] LAPW2
علاء عبد الحميد
- [Wien] LAPW2C stop
Zahia Aboub
- [Wien] LAPW2C stop
Antônio Vanbderlei dos Santos
- [Wien] LAPW2C stop
Laurence Marks
- [Wien] LAPW2C stop
Laurence Marks
- [Wien] LAPW2C stop
Lyudmila Dobysheva
- [Wien] LAPW2C stop
Lyudmila Dobysheva
- [Wien] LAPW2C stop
Zahia Aboub
- [Wien] LAPW2C stop
Zahia Aboub
- [Wien] LAPW2C stop
Laurence Marks
- [Wien] LAPW2C stop
Zahia Aboub
- [Wien] LAPW2C stop
Laurence Marks
- [Wien] LAPW2C stop
Zahia Aboub
- [Wien] LAPW2C stop
Laurence Marks
- [Wien] Lapwso crashed when running the program in parallel mode
Madhav Ghimire
- [Wien] Lapwso crashed when running the program in parallel mode
Peter Blaha
- [Wien] LDA+U
علاء عبد الحميد
- [Wien] LDA+U
Rocquefelte
- [Wien] LDA+U error
Nishaina Sahadev
- [Wien] lsart
ben amara imen
- [Wien] lsart
Stefaan Cottenier
- [Wien] lstart
ben amara imen
- [Wien] lstart
Rocquefelte
- [Wien] minor error in lapwso Wien2k_11.1
김 규
- [Wien] minor error in lapwso Wien2k_11.1
Peter Blaha
- [Wien] plz help required
arqum hashmi
- [Wien] plz help required
Laurence Marks
- [Wien] plz help required
arqum hashmi
- [Wien] plz help required
arqum hashmi
- [Wien] plz help required
arqum hashmi
- [Wien] plz help required
Laurence Marks
- [Wien] plz help required
arqum hashmi
- [Wien] plz help required
arqum hashmi
- [Wien] plz help required
MOWAFAQ MOHAMMAD KETHYAN AL-SARDIA
- [Wien] plz help required
Laurence Marks
- [Wien] plz help required
arqum hashmi
- [Wien] plz help required
Laurence Marks
- [Wien] query about OPTION 6 in volume optimization in which we can vary a, b and c (3D case)
shamik chakrabarti
- [Wien] query about OPTION 6 in volume optimization in which we can vary a, b and c (3D case)
Laurence Marks
- [Wien] query about OPTION 6 in volume optimization in which we can vary a, b and c (3D case)
shamik chakrabarti
- [Wien] query about OPTION 6 in volume optimization in which we can vary a, b and c (3D case)
Peter Blaha
- [Wien] query about OPTION 6 in volume optimization in which we can vary a, b and c (3D case)
shamik chakrabarti
- [Wien] question about the option 6 of the optimization
sufyan
- [Wien] question on how to rotate the axis in qtl propram
王静
- [Wien] question on how to rotate the axis in qtl propram
Peter Blaha
- [Wien] Question on spin-orbit coupling calculation
hyunjung kim
- [Wien] Questions on the quantitative understanding of DOS and partial DOS
Lee, Yongbin [A LAB]
- [Wien] Questions on the quantitative understanding of DOS and partial DOS
J. K. Balamurugan
- [Wien] Questions on the quantitative understanding of DOS and partial DOS
David Tompsett
- [Wien] Questions on the quantitative understanding of DOS and partial DOS
J. K. Balamurugan
- [Wien] Reg: k-point parallel submission of script to the HPC
shwetha gummula
- [Wien] Reg: k-point parallel submission of script to the HPC
pascal boulet
- [Wien] Reg: k-point parallel submission of script to the HPC
shwetha gummula
- [Wien] Reg: k-point parallel submission of script to the HPC
shwetha gummula
- [Wien] Reg: k-point parallel submission of script to the HPC
Peter Blaha
- [Wien] Reg: k-point parallel submission of script to the HPC
shwetha gummula
- [Wien] Reg: k-point parallel submission of script to the HPC
Gavin Abo
- [Wien] Reg: k-point parallel submission of script to the HPC
Eamon McDermott
- [Wien] Reg: k-point parallel submission of script to the HPC
shwetha gummula
- [Wien] SCF 1st cycle keeps on running at LAPW2 and doesn't go further
Masood Yousaf
- [Wien] SCF 1st cycle keeps on running at LAPW2 and doesn't go further
Laurence Marks
- [Wien] SCF 1st cycle keeps on running at LAPW2 and doesn't go further
Laurence Marks
- [Wien] SCF 1st cycle keeps on running at LAPW2 and doesn't go further
Laurence Marks
- [Wien] SCF Run problem
Jagdish Nehra
- [Wien] SCF Run problem
Gavin Abo
- [Wien] SCF run problem
Jagdish Nehra
- [Wien] SCF run problem
Laurence Marks
- [Wien] SCF run problem
Laurence Marks
- [Wien] Some confirmation regarding SO calculation
Vinayak Mishra
- [Wien] sp2, sp3 hybridization and Pz, Px, Py
Zhou Bing
- [Wien] spin density
kangbugy at lycos.co.kr
- [Wien] spin density
Rocquefelte
- [Wien] SPIN ORBIT COUPLING and Band structure picture
Madhav Ghimire
- [Wien] SPIN ORBIT COUPLING and Band structure picture
Peter Blaha
- [Wien] STOP CORE END
Masood Yousaf
- [Wien] STOP CORE END
Stefaan Cottenier
- [Wien] Telnes3 compilation
aeljarrat at el.ub.edu
- [Wien] Telnes3 compilation
Peter Blaha
- [Wien] Telnes3 compilation
aeljarrat at el.ub.edu
- [Wien] TELNES3 with spin
Che Seabourne
- [Wien] TELNES3 with spin
Peter Blaha
- [Wien] The band structure of CuAlO2- SG 166
Osama Yassin
- [Wien] The band structure of CuAlO2- SG 166
Peter Blaha
- [Wien] The band structure of CuAlO2- SG 166
Osama Yassin
- [Wien] the effec of the volume optimization on the magnetic configuration
Fecher, Gerhard
- [Wien] the effec of the volume optimization on the magnetic configuration
sufyan
- [Wien] the orientation between EFG tensor and crystal frame directions
Zhou Bing
- [Wien] the orientation between EFG tensor and crystal frame directions
Peter Blaha
- [Wien] the orientation between EFG tensor and crystal frame directions
Zhou Bing
- [Wien] the parameter of denominator in the file of case.in5
Zhou Bing
- [Wien] the parameter of denominator in the file of case.in5
Rocquefelte
- [Wien] the parameter of denominator in the file of case.in5
Zhou Bing
- [Wien] the parameter of denominator in the file of case.in5
Rocquefelte
- [Wien] the parameter of denominator in the file of case.in5
Zhou Bing
- [Wien] Unable to run spin-orbit calculation for non-spin cases
Madhav Ghimire
- [Wien] Vec2old_LAPW
ahmad gharleghi
- [Wien] Vec2old_LAPW
Laurence Marks
- [Wien] Vec2old_LAPW
ahmad gharleghi
- [Wien] Vec2old_LAPW
Laurence Marks
- [Wien] w2web
Sohail Ahmad
- [Wien] w2web
Gavin Abo
- [Wien] WIENNCM + spin-orbit
Lyudmila Dobysheva
- [Wien] WIENNCM + spin-orbit
Robert Laskowski
- [Wien] WIENNCM + spin-orbit
Peter Blaha
- [Wien] WIENNCM + spin-orbit
Lyudmila Dobysheva
- [Wien] XCRYSDEN
Zhou Bing
- [Wien] إعادة توجيه: EF not accurate
Zahia Aboub
- [Wien] إعادة توجيه: EF not accurate
Zahia Aboub
- [Wien] إعادة توجيه: EF not accurate
Laurence Marks
Last message date:
Fri Mar 30 17:27:02 CEST 2012
Archived on: Fri Mar 30 17:27:30 CEST 2012
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