May 2008 Archives by author

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Starting: Thu May 1 19:53:57 CEST 2008
Ending: Thu May 29 07:27:07 CEST 2008
Messages: 105

• [Wien] Can I calculate the velocity of electrons V(kx, ky, kz) by wien2k?   Bahram Abedi
• [Wien] Wien Digest, Vol 37, Issue 2   Prateep Bisht
• [Wien] strange behaviour of DOS   Prateep Bisht
• [Wien] wien2k 08 version troubles   Peter Blaha
• [Wien] error in lapw1 at cycle4   Peter Blaha
• [Wien] lstart stops with "NSTOP= 362 FOR THE ORBITAL 2S"   Peter Blaha
• [Wien] 2nd question about: One further modification for lattices that have inversion symmetry???   Peter Blaha
• [Wien] Can I include a charged vacancy?   Peter Blaha
• [Wien] SYM program   Peter Blaha
• [Wien] question   Peter Blaha
• [Wien] Segmentation fault in LAPW1   Peter Blaha
• [Wien] Normalization of Lattice harmonics in Wien2k   Peter Blaha
• [Wien] PhD position in Nantes   Peter Blaha
• [Wien] irreducible representation   Peter Blaha
• [Wien] case.vector and case.output1 in k-parallel   Peter Blaha
• [Wien] case.vector and case.output1 in k-parallel   Peter Blaha
• [Wien] A question about unit of electric field in in0   Peter Blaha
• [Wien] possible orb bug?   Peter Blaha
• [Wien] PhD positions in Vienna   Peter Blaha
• [Wien] Warking in SCF cycles "WARNING: EF not accurate, new emin, emax, NE-min, NE-max"   Peter Blaha
• [Wien] Energy gap in PbTe   ARIN CHURCH
• [Wien] Problems with lapw1   Luiz Cláudio Carvalho
• [Wien] Problem running SCF cycle   Arun Kr. Chatterjee
• [Wien] problem in running SCF   Arun Kr. Chatterjee
• [Wien] wien2k 08 version troubles   Igor Djerdj
• [Wien] irreducible representation   Igor Djerdj
• [Wien] Segmentation fault in LAPW1   Lyudmila Dobysheva
• [Wien] Problem with function optimize.   Lyudmila Dobysheva
• [Wien] electron density plot   Georg Eickerling
• [Wien] possible orb bug?   Ricardo Faccio
• [Wien] possible orb bug?   Ricardo Faccio
• [Wien] possible orb bug?   Ricardo Faccio
• [Wien] Problems with lapw1   Gerhard Fecher
• [Wien] Segmentation fault in LAPW1   Gerhard Fecher
• [Wien] Problem running SCF cycle   Gerhard Fecher
• [Wien] Segmentation fault in LAPW1   Gerhard Fecher
• [Wien] calculating integration of the 3 spherical harmonics for calculating the charge density (Gaunt coefficients).   Gerhard Fecher
• [Wien] Modeling of Ag5Pb2O6   Michael Fischer
• [Wien] Normalization of Lattice harmonics in Wien2k   Maurits W. Haverkort
• [Wien] the integration of product of 3 spherical harmonics (Gaunt coefficients)   Maurits W. Haverkort
• [Wien] partial charge density distribution   TSUCHIURA Hiroki
• [Wien] Sum of PDOSes doesn't give total DOS   David Holec
• [Wien] Sum of PDOSes doesn't give total DOS   David Holec
• [Wien] Sum of PDOSes doesn't give total DOS   David Holec
• [Wien] 3D charge density   David Holec
• [Wien] Modeling of Ag5Pb2O6   David Holec
• [Wien] Warking in SCF cycles "WARNING: EF not accurate, new emin, emax, NE-min, NE-max"   J.H. Mokkath, FB18
• [Wien] Warning in SCF cycles "WARNING: EF not accurate, new emin, emax, NE-min, NE-max"   J.H. Mokkath, FB18
• [Wien] Problems with lapw1   Hong Jiang
• [Wien] Segmentation fault in LAPW1   Dimitris Kechrakos
• [Wien] Segmentation fault in LAPW1   Dimitris Kechrakos
• [Wien] a problem in the extended DOS above fermi level   Robert Laskowski
• [Wien] Problem with function optimize.   Robert Laskowski
• [Wien] Intel MKL 10.0 Update 3   Laurence Marks
• [Wien] External electric field!   Laurence Marks
• [Wien] Sum of PDOSes doesn't give total DOS   Cormac McGuinness
• [Wien] Running LDA+U from w2web   Yurko Natanzon
• [Wien] How to check band structure calculation progress   Rocquefelte
• [Wien] MSc/PhD Studentships Computational Materials Science   Peter Sirsch
• [Wien] a problem in the extended DOS above fermi level   Dong Su
• [Wien] Error in installing Wien2K (MPI parallel version)   Nandan Tandon
• [Wien] problem with compiling mpi executable   Nandan Tandon
• [Wien] Modeling of Ag5Pb2O6   Ivas Toni
• [Wien] Problem with function optimize.   Dima Vingurt
• [Wien] Energy gap in PbTe   Dima Vingurt
• [Wien] Problem with function optimize.   Dima Vingurt
• [Wien] DOS plot for FSM   Xueli Wang
• [Wien] Running wien2k on Macbook Pro   Yu Xie
• [Wien] can wien2k do this?   Wei Zhou
• [Wien] Installation of WIEN2K   shameem banu
• [Wien] (no subject)   shameem banu
• [Wien] PhD position in Nantes   farouk boutaiba
• [Wien] Segmentation fault in LAPW1   swati chaudhury
• [Wien] One further modification for lattices that have inversion symmetry???   fatemeh.mirjani
• [Wien] 2nd question about: One further modification for lattices that have inversion symmetry???   fatemeh.mirjani
• [Wien] difference between the number of bands in the spheres and in the interstitial region??   fatemeh.mirjani
• [Wien] calculating integration of the 3 spherical harmonics for calculating the charge density (Gaunt coefficients).   fatemeh.mirjani
• [Wien] the integration of product of 3 spherical harmonics (Gaunt coefficients)   fatemeh.mirjani
• [Wien] A regular mesh of kpoints   fatemeh.mirjani
• [Wien] SYM program   hamad at fhi-berlin.mpg.de
• [Wien] labeling band   ben abdallah houda
• [Wien] program for configuration case.indm and case.inorb(prof. Blaha)   morteza jamal
• [Wien] error in lapw1 at cycle4   samaneh javan
• [Wien] Fwd: error in lapw1 at cycle4   samaneh javan
• [Wien] error in lapw1 at cycle4   samaneh javan
• [Wien] electron density plot   muniroh
• [Wien] electron density plot   muniroh
• [Wien] case.vector and case.output1 in k-parallel   nluo at uiuc.edu
• [Wien] case.vector and case.output1 in k-parallel   nluo at uiuc.edu
• [Wien] case.vector and case.output1 in k-parallel   nluo at uiuc.edu
• [Wien] question   hazem salem
• [Wien] encountering to error 2,3 within installing wien2008   moj zar
• [Wien] Molecular Orbital   tomi zaya
• [Wien] Can I include a charged vacancy?   zhao
• [Wien] External electric field!   zhao
• [Wien] External electric field!   zhao
• [Wien] External electric field!   zhao
• [Wien] External electric field!   zhao
• [Wien] electron density plot   zhao
• [Wien] A question about unit of electric field in in0   zhao
• [Wien] A question about unit of electric field in in0   zhao
• [Wien] 3D charge density   zhchwsd at 163.com
• [Wien] vacancy-calculation   zhchwsd at 163.com
• [Wien] lstart stops with "NSTOP= 362 FOR THE ORBITAL 2S"   zhs064
• [Wien] How to check band structure calculation progress   zubaer

Last message date: Thu May 29 07:27:07 CEST 2008
Archived on: Thu May 29 06:27:44 CEST 2008

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