January 2020 Archives by author

• Messages sorted by: [ thread ] [ subject ] [ date ]
• More info on this list...

Starting: Wed Jan 1 22:37:28 CET 2020
Ending: Fri Jan 31 19:09:33 CET 2020
Messages: 143

• [Wien] Error in OPTIC calculations   Gavin Abo
• [Wien] Error during scf calculation of PbI2   Gavin Abo
• [Wien] Raman Tensors   Gavin Abo
• [Wien] plane wave exhausted error   Gavin Abo
• [Wien] AFM type II   Gavin Abo
• [Wien] AFM type II   Gavin Abo
• [Wien] AFM type II   Gavin Abo
• [Wien] allocating number of cores to a job   Ali Baghizhadeh
• [Wien] density matrix is not positive   Peter Blaha
• [Wien] wien2venus.py for non-cubic crystallographic system   Peter Blaha
• [Wien] density matrix is not positive   Peter Blaha
• [Wien] density matrix is not positive   Peter Blaha
• [Wien] density matrix is not positive   Peter Blaha
• [Wien] GLLB-SC   Peter Blaha
• [Wien] something about density   Peter Blaha
• [Wien] something about density   Peter Blaha
• [Wien] something about density   Peter Blaha
• [Wien] Inverse spinel to normal spinel structure transformation in wien2k   Peter Blaha
• [Wien] Decomposition of Density of States   Peter Blaha
• [Wien] plane wave exhausted error   Peter Blaha
• [Wien] Parallel execution   Peter Blaha
• [Wien] Is calculating the chemical shielding (orbital part) in paramagnetic system using x_nmr_lapw available ? x_nmr_lapw? lapwdm? DIPAN?   Peter Blaha
• [Wien] "LAPW2: semicore band-ranges too large" error in LSDA+SO   Peter Blaha
• [Wien] allocating number of cores to a job   Peter Blaha
• [Wien] Ghost band error in SnS2 continued....   Peter Blaha
• [Wien] Ghost band error in SnS2 continued....   Peter Blaha
• [Wien] Is calculating the chemical shielding (orbital part) in paramagnetic system using x_nmr_lapw available ? x_nmr_lapw? lapwdm? DIPAN?   Peter Blaha
• [Wien] Ask for help   Peter Blaha
• [Wien] Ce does not converge   Peter Blaha
• [Wien] "LAPW2: semicore band-ranges too large" error in LSDA+SO   Peter Blaha
• [Wien] Mismatch in the Fermi level between Wien2K open core calculations and VASP   Peter Blaha
• [Wien] something about the density matrix   Peter Blaha
• [Wien] something about the density matrix   Peter Blaha
• [Wien] Mismatch in the Fermi level between Wien2K open core calculations and VASP   Peter Blaha
• [Wien] Mismatch in the Fermi level between Wien2K open core calculations and VASP   Peter Blaha
• [Wien] Is calculating the chemical shielding (orbital part) in paramagnetic system using x_nmr_lapw available ? x_nmr_lapw? lapwdm? DIPAN?   Peter Blaha
• [Wien] WIEN2k workshop   Peter Blaha
• [Wien] HUMO LUMO   Peter Blaha
• [Wien] "LAPW2: semicore band-ranges too large" error in LSDA+SO   Dibyendu DEY
• [Wien] "LAPW2: semicore band-ranges too large" error in LSDA+SO   Dibyendu DEY
• [Wien] density matrix is not positive   Fan
• [Wien] density matrix is not positive   Fan
• [Wien] Error in orbital potential calculations   Fan
• [Wien] Ghost band error in SnS2 continued....   Fecher, Gerhard
• [Wien] AFM type II   Fecher, Gerhard
• [Wien] Error in LAPW2   Riyajul Islam
• [Wien] HUMO LUMO   Wahid Kamal
• [Wien] wien2venus.py for non-cubic crystallographic system   Martin Kroeker
• [Wien] density matrix is not positive   Martin Kroeker
• [Wien] density matrix is not positive   Llin Layton
• [Wien] Ask for help   Siham Malki
• [Wien] Ask for help   Siham Malki
• [Wien] density matrix is not positive   Laurence Marks
• [Wien] density matrix is not positive   Laurence Marks
• [Wien] density matrix is not positive   Laurence Marks
• [Wien] density matrix is not positive   Laurence Marks
• [Wien] density matrix is not positive   Laurence Marks
• [Wien] density matrix is not positive   Laurence Marks
• [Wien] Spin (not charge) sloshing   Laurence Marks
• [Wien] GGA+U   Laurence Marks
• [Wien] density matrix is not positive   Laurence Marks
• [Wien] [Wien2k] help for AFM calculations   Laurence Marks
• [Wien] Error during scf calculation of PbI2   Laurence Marks
• [Wien] Error in orbital potential calculations   Laurence Marks
• [Wien] Error during scf calculation of PbI2   Laurence Marks
• [Wien] Error in LAPW2   Laurence Marks
• [Wien] Ghost band error   Laurence Marks
• [Wien] Ghost band error   Laurence Marks
• [Wien] Ghost band error   Laurence Marks
• [Wien] Ghost band error   Laurence Marks
• [Wien] allocating number of cores to a job   Laurence Marks
• [Wien] Ghost band error in SnS2 continued....   Laurence Marks
• [Wien] Ghost band error in SnS2 continued....   Laurence Marks
• [Wien] Ghost band error in SnS2 continued....   Laurence Marks
• [Wien] Ghost band error in SnS2 continued....   Laurence Marks
• [Wien] Ce does not converge   Laurence Marks
• [Wien] Ce does not converge   Laurence Marks
• [Wien] Mismatch in the Fermi level between Wien2K open core calculations and VASP   Laurence Marks
• [Wien] Mismatch in the Fermi level between Wien2K open core calculations and VASP   Laurence Marks
• [Wien] Error in OPTIC calculations   Victoria Maxwel
• [Wien] Ask for help   Pavel Ondračka
• [Wien] Error during scf calculation of PbI2   Subhasis Panda
• [Wien] Error during scf calculation of PbI2   Subhasis Panda
• [Wien] Error during scf calculation of PbI2   Subhasis Panda
• [Wien] Error during scf calculation of PbI2   Subhasis Panda
• [Wien] born effective charge tensors   Oleg Rubel
• [Wien] Parallel execution   S quyoom Seh
• [Wien] Mismatch in the Fermi level between Wien2K open core calculations and VASP   Anup Shakya
• [Wien] Mismatch in the Fermi level between Wien2K open core calculations and VASP   Anup Shakya
• [Wien] Mismatch in the Fermi level between Wien2K open core calculations and VASP   Anup Shakya
• [Wien] mBJ with DFT-D3   Tran, Fabien
• [Wien] Is calculating the chemical shielding (orbital part) in paramagnetic system using x_nmr_lapw available ? x_nmr_lapw? lapwdm? DIPAN?   Tran, Fabien
• [Wien] Ce does not converge   Tran, Fabien
• [Wien] Ce does not converge   Tran, Fabien
• [Wien] something about the density matrix   Tran, Fabien
• [Wien] HUMO LUMO   Tran, Fabien
• [Wien] GLLB-SC   Wien2k User
• [Wien] Raman Tensors   Wien2k User
• [Wien] born effective charge tensors   Wien2k User
• [Wien] wien2venus.py for non-cubic crystallographic system   DAWEI WEN
• [Wien] Density of States decomposition   Guoping Zhang
• [Wien] Decomposition of Density of States   Guoping Zhang
• [Wien] Inverse spinel to normal spinel structure transformation in wien2k   shamik chakrabarti
• [Wien] Inverse spinel to normal spinel structure transformation in wien2k   shamik chakrabarti
• [Wien] Structure optimization of spinel   shamik chakrabarti
• [Wien] plane wave exhausted error   shamik chakrabarti
• [Wien] plane wave exhausted error   shamik chakrabarti
• [Wien] Ghost band error appeared after adding U to Sn for SnO2   shamik chakrabarti
• [Wien] Fwd: Ghost band error appeared after adding U to Sn for SnO2   shamik chakrabarti
• [Wien] Ghost band error   shamik chakrabarti
• [Wien] Ghost band error   shamik chakrabarti
• [Wien] Ghost band error   shamik chakrabarti
• [Wien] Ghost band error   shamik chakrabarti
• [Wien] Ghost band error   shamik chakrabarti
• [Wien] Ghost band error in SnS2 continued....   shamik chakrabarti
• [Wien] Ghost band error in SnS2 continued....   shamik chakrabarti
• [Wien] Ghost band error in SnS2 continued....   shamik chakrabarti
• [Wien] Structure optimization of spinel   delamora
• [Wien] Ce does not converge   delamora
• [Wien] [Wien2K] help for EELS calculations in a spin-polarized system   sha haozhi
• [Wien] [Wien2k] help for AFM calculations   sha haozhi
• [Wien] Error in orbital potential calculations   sha haozhi
• [Wien] density matrix is not positive   pieper
• [Wien] density matrix is not positive   pieper
• [Wien] AFM type II   pieper
• [Wien] AFM type II   pieper
• [Wien] AFM type II   pieper
• [Wien] mBJ with DFT-D3   djamel slamnia
• [Wien] mBJ with DFT-D3   djamel slamnia
• [Wien] Decomposition of Density of States   djamel slamnia
• [Wien] AFM type II   djamel slamnia
• [Wien] AFM type II   djamel slamnia
• [Wien] AFM type II   djamel slamnia
• [Wien] AFM type II   djamel slamnia
• [Wien] GGA+U   usuf zai
• [Wien] something about density   姜若诗
• [Wien] something about density   姜若诗
• [Wien] something about the density matrix   姜若诗
• [Wien] something about the density matrix   姜若诗
• [Wien] something about the density matrix   姜若诗
• [Wien] Is calculating the chemical shielding (orbital part) in paramagnetic system using x_nmr_lapw available ? x_nmr_lapw? lapwdm? DIPAN?   林敏
• [Wien] Is calculating the chemical shielding (orbital part) in paramagnetic system using x_nmr_lapw available ? x_nmr_lapw? lapwdm? DIPAN?   林敏
• [Wien] Is calculating the chemical shielding (orbital part) in paramagnetic system using x_nmr_lapw available ? x_nmr_lapw? lapwdm? DIPAN?   踢球者

Last message date: Fri Jan 31 19:09:33 CET 2020
Archived on: Fri Jan 31 19:09:37 CET 2020

• Messages sorted by: [ thread ] [ subject ] [ date ]
• More info on this list...