March 2015 Archives by subject
Starting: Mon Mar 2 05:20:20 CET 2015
Ending: Tue Mar 31 18:19:27 CEST 2015
Messages: 164
- [Wien] (no subject)
Qasim Mahmood
- [Wien] (no subject)
Gavin Abo
- [Wien] (no subject)
Suman Bangar
- [Wien] [WIEN]about the file case.radwf
剑去无痕
- [Wien] [WIEN]about the file case.radwf
tran at theochem.tuwien.ac.at
- [Wien] [WIEN]about the file case.radwf
Peter Blaha
- [Wien] [WIEN]about wave function in WIEN2k
F.Tang
- [Wien] [WIEN]about wave function in WIEN2k
tran at theochem.tuwien.ac.at
- [Wien] About core-hole calculations for XSPEC:
Tuan Vu
- [Wien] About core-hole calculations for XSPEC:
Peter Blaha
- [Wien] AFM Calculations
Murugan Sundareswari
- [Wien] Best RKmax
Hannan.Sadek at uv.es
- [Wien] Best RKmax
Peter Blaha
- [Wien] Best RKmax
Hannan.Sadek at uv.es
- [Wien] Best RKmax
Gavin Abo
- [Wien] Boltztrap for spin polarized materials
Murugan Sundareswari
- [Wien] Boltztrap for spin polarized materials
Gavin Abo
- [Wien] Boltztrap for spin polarized materials
Murugan Sundareswari
- [Wien] Determine primitive cell and positions, CXZ LATTICE 15_B2/b
David Olmsted
- [Wien] Determine primitive cell and positions, CXZ LATTICE 15_B2/b
Peter Blaha
- [Wien] Determine primitive cell and positions, CXZ LATTICE 15_B2/b
Terki Férial
- [Wien] Determine primitive cell and positions, CXZ LATTICE 15_B2/b
David Olmsted
- [Wien] Determine primitive cell and positions, CXZ LATTICE 15_B2/b
Peter Blaha
- [Wien] Determine primitive cell and positions, CXZ LATTICE 15_B2/b
Laurence Marks
- [Wien] Determine primitive cell and positions, CXZ LATTICE 15_B2/b
David Olmsted
- [Wien] DFT of a normal spinel
shamik chakrabarti
- [Wien] DFT of a normal spinel
shamik chakrabarti
- [Wien] DOS plot
delamora
- [Wien] DOS spin polarized in WIEN2k-14.2
delamora
- [Wien] DOS spin polarized in WIEN2k-14.2
delamora
- [Wien] DOS spin polarized in WIEN2k-14.2
Gavin Abo
- [Wien] DOS spin polarized in WIEN2k-14.2
Peter Blaha
- [Wien] eigenfunction in WIEN2k
F.Tang
- [Wien] error in wannier function plotting with wien2wannier
wasim raja Mondal
- [Wien] Error message during compilation
farouk boutaiba
- [Wien] Error message during compilation
Laurence Marks
- [Wien] Error message during compilation
farouk boutaiba
- [Wien] Error message during compilation
Gavin Abo
- [Wien] Error message during scf calculation
farouk boutaiba
- [Wien] Error message during scf calculation
Gavin Abo
- [Wien] Error message during scf calculation
farouk boutaiba
- [Wien] Error message during scf calculation
farouk boutaiba
- [Wien] Error message during scf calculation
Gavin Abo
- [Wien] Error message during scf calculation
farouk boutaiba
- [Wien] Error message during scf calculation
Gavin Abo
- [Wien] Error message during scf calculation
farouk boutaiba
- [Wien] Error message during scf calculation
Pascal Boulet
- [Wien] Error message during scf calculation
Gavin Abo
- [Wien] Error message during scf calculation
Pascal Boulet
- [Wien] Error message during scf calculation
Gavin Abo
- [Wien] Error message during scf calculation
farouk boutaiba
- [Wien] Fw: NN error during initialization
Lawal Mohammed
- [Wien] Fw: NN error during initialization
Fecher, Gerhard
- [Wien] Ghostbands: pushed energy range in case.in1 to 6.3, does this mean there is a problem?
David Olmsted
- [Wien] Ghostbands: pushed energy range in case.in1 to 6.3, does this mean there is a problem?
Peter Blaha
- [Wien] Ghostbands: pushed energy range in case.in1 to 6.3, does this mean there is a problem?
David Olmsted
- [Wien] Ghostbands: pushed energy range in case.in1 to 6.3, does this mean there is a problem?
Peter Blaha
- [Wien] Ghostbands: pushed energy range in case.in1 to 6.3, does this mean there is a problem?
David Olmsted
- [Wien] Ghostbands: pushed energy range in case.in1 to 6.3, does this mean there is a problem?
Peter Blaha
- [Wien] Hybrid Test on MgO
Paul Fons
- [Wien] incorrect determination of multiplicity by nn
mazin
- [Wien] incorrect determination of multiplicity by nn
Peter Blaha
- [Wien] LDA-GGA and van der Waals
Osama Yassin
- [Wien] LDA-GGA and van der Waals
tran at theochem.tuwien.ac.at
- [Wien] LDA-GGA and van der Waals
Osama Yassin
- [Wien] minor filtvec troubles
Pavel Ondracka
- [Wien] minor filtvec troubles
Peter Blaha
- [Wien] Mo+Si, is a U needed ?
Laurence Marks
- [Wien] Mo+Si, is a U needed ?
Peter Blaha
- [Wien] NMR calculation
Ary Ferreira
- [Wien] NMR calculation
Robert Laskowski
- [Wien] Nuclear charge shows as lowered with core hole (:NEC lines)
David Olmsted
- [Wien] Nuclear charge shows as lowered with core hole (:NEC lines)
Peter Blaha
- [Wien] Optimization of atomic positions
Peter Blaha
- [Wien] Optimization of atomic positions
Mohammed Abujafar
- [Wien] Optimization of atomic positions
Peter Blaha
- [Wien] Optimization of atomic positions
Mohammed Abujafar
- [Wien] Optimization of atomic positions
Peter Blaha
- [Wien] Optimization of atomic positions
Mohammed Abujafar
- [Wien] optimizing atomic positions
Mohammed Abujafar
- [Wien] optimizing atomic positions
Laurence Marks
- [Wien] Plotting momentum resolved density of states
Dileep Krishnan
- [Wien] Problems with case.weighf file
Fons Paul
- [Wien] Problems with case.weighf file
Peter Blaha
- [Wien] Problems with hybrid calculation
Paul Fons
- [Wien] Problems with hybrid calculation
tran at theochem.tuwien.ac.at
- [Wien] Problems with hybrid calculation
Paul Fons
- [Wien] Problems with hybrid calculation
Pavel Ondracka
- [Wien] Problems with hybrid calculation
tran at theochem.tuwien.ac.at
- [Wien] Problems with hybrid calculations: case.vectorhf_old file missing
Paul Fons
- [Wien] Problems with hybrid calculations: case.vectorhf_old file missing
Paul Fons
- [Wien] Problems with hybrid calculations: case.vectorhf_old file missing
Peter Blaha
- [Wien] Problems with parallel hybrid functional calculation
Paul Fons
- [Wien] Problems with parallel hybrid functional calculation
Gavin Abo
- [Wien] Problems with parallel hybrid functional calculation
Peter Blaha
- [Wien] Quadrupole transition for XAS
tscchung
- [Wien] Quadrupole transition for XAS
Kevin Jorissen
- [Wien] Reference point of Fermi energy
Mohammed Abujafar
- [Wien] Reference point of Fermi energy
Peter Blaha
- [Wien] Reg. installation of Wien2k 14.2
Dr. K. Balamurugan
- [Wien] reletivistic effects
Ридный Ярослав Максимович
- [Wien] reletivistic effects
Xavier Rocquefelte
- [Wien] restricting magnetic moment of individual atom
محمد ارشد فرحان
- [Wien] restricting magnetic moment of individual atom
Peter Blaha
- [Wien] semicore band-ranges too large problem
bayarr temuujin
- [Wien] semicore band-ranges too large problem
Lyudmila Dobysheva
- [Wien] semicore band-ranges too large problem
Gavin Abo
- [Wien] Space group P4(2)/nmc (137)
Ary Ferreira
- [Wien] Space group P4(2)/nmc (137)
Peter Blaha
- [Wien] Space group P4(2)/nmc (137)
Víctor Luaña Cabal
- [Wien] supercell calculation not converging
saurabh samant
- [Wien] supercell calculation not converging
Lyudmila Dobysheva
- [Wien] supercell calculation not converging
Lyudmila Dobysheva
- [Wien] supercell calculation not converging
saurabh samant
- [Wien] supercell calculation not converging
Lyudmila Dobysheva
- [Wien] t2g -eg plot
Vijeta Singh
- [Wien] t2g -eg plot
Rishi Singh
- [Wien] TELNES Phosphorus L23 and L1 edge
massimiliano amato
- [Wien] TELNES Phosphorus L23 and L1 edge
Kevin Jorissen
- [Wien] temparature calculation
Murugan Sundareswari
- [Wien] temparature calculation
Víctor Luaña Cabal
- [Wien] TiC-example SCF error
Khandmaa TS
- [Wien] TiC-example SCF error
Peter Blaha
- [Wien] TiC-example SCF error
Peter Blaha
- [Wien] TiC-example SCF error
Khandmaa TS
- [Wien] TiC-example SCF error
Peter Blaha
- [Wien] TiC-example SCF error
Khandmaa TS
- [Wien] TiC-example SCF error
Peter Blaha
- [Wien] TiC-example SCF error
Khandmaa TS
- [Wien] TiC-example SCF error
Peter Blaha
- [Wien] TiC-example SCF error
Khandmaa TS
- [Wien] TiC-example SCF error
Peter Blaha
- [Wien] TiC example fails with memory corruption error on Mixer
Williams, Alan
- [Wien] TiC example fails with memory corruption error on Mixer
Laurence Marks
- [Wien] TiC example fails with memory corruption error on Mixer
Williams, Alan
- [Wien] TiC example fails with memory corruption error on Mixer
Laurence Marks
- [Wien] trouble with rxes calculations
Tolhurst, Thomas
- [Wien] Update on hybrid troubles
Paul Fons
- [Wien] Update on hybrid troubles
Paul Fons
- [Wien] Update on hybrid troubles
tran at theochem.tuwien.ac.at
- [Wien] Update on hybrid troubles
FonsPaul
- [Wien] Update on hybrid troubles
Peter Blaha
- [Wien] Update on hybrid troubles
tran at theochem.tuwien.ac.at
- [Wien] WIEN2k workshop
Peter Blaha
- [Wien] WIEN2k workshop
Gunakar Das
- [Wien] WIEN2k workshop
Peter Blaha
- [Wien] WIEN2k workshop
Ong Phuong Khuong (IHPC)
- [Wien] wien2wannier interface
wasim raja Mondal
- [Wien] wien2wannier interface
Elias Assmann
- [Wien] wien2wannier interface
wasim raja Mondal
- [Wien] wien2wannier interface
wasim raja Mondal
- [Wien] wien2wannier interface
Elias Assmann
- [Wien] wien2wannier interface
Elias Assmann
- [Wien] wien2wannier interface
wasim raja Mondal
- [Wien] wien2wannier interface
Elias Assmann
- [Wien] wien2wannier interface
wasim raja Mondal
- [Wien] wien2wannier interface
Elias Assmann
- [Wien] wien2wannier interface
Kyohn Ahn
- [Wien] wien2wannier interface
wasim raja Mondal
- [Wien] wien2wannier interface
Elias Assmann
- [Wien] wien2wannier interface
wasim raja Mondal
- [Wien] wien2wannier interface
Elias Assmann
- [Wien] wien2wannier interface
Kyohn Ahn
- [Wien] wien2wannier interface
Elias Assmann
Last message date:
Tue Mar 31 18:19:27 CEST 2015
Archived on: Tue Mar 31 18:19:34 CEST 2015
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