December 2019 Archives by date
Starting: Mon Dec 2 10:13:04 CET 2019
Ending: Tue Dec 31 09:05:47 CET 2019
Messages: 119
- [Wien] Lapw2_1.def ERROR
Ashwani Kumar
- [Wien] Lapw2_1.def ERROR
Lyudmila Dobysheva
- [Wien] Fwd: Lapw2_1.def ERROR
Ashwani Kumar
- [Wien] Fwd: Lapw2_1.def ERROR
Laurence Marks
- [Wien] Fwd: Lapw2_1.def ERROR
Ashwani Kumar
- [Wien] tauwrong message..
Subhasis Panda
- [Wien] tauwrong message..
Tran, Fabien
- [Wien] tauwrong message..
Subhasis Panda
- [Wien] tauwrong message..
Tran, Fabien
- [Wien] Fwd: Lapw2_1.def ERROR
Laurence Marks
- [Wien] tauwrong message..
Subhasis Panda
- [Wien] Issues with Wien2k installation
Vidit Zala
- [Wien] Issues with Wien2k installation
Pavel Ondračka
- [Wien] Band Edge position
Subhasis Panda
- [Wien] Upgrade to WIEN2k_19.1_lapw2_error
Ashwani Kumar
- [Wien] Upgrade to WIEN2k_19.1_lapw2_error
Laurence Marks
- [Wien] How to do a spin polarized calculation from a non spin spolarized calculation ?
Abderrahmane Reggad
- [Wien] Upgrade to WIEN2k_19.1_lapw2_error
Peter Blaha
- [Wien] How to do a spin polarized calculation from a non spin spolarized calculation ?
Peter Blaha
- [Wien] Upgrade to WIEN2k_19.1_lapw2_error
Gavin Abo
- [Wien] LDA+U calculations at with U at selected atoms
david yang
- [Wien] LDA+U calculations at with U at selected atoms
Tran, Fabien
- [Wien] Fwd: Band Edge position
Subhasis Panda
- [Wien] LDA+U calculations at with U at selected atoms
Peter Blaha
- [Wien] spin-orbit (PBE and mBJ) for perovskites
Mikhail Nestoklon
- [Wien] spin-orbit (PBE and mBJ) for perovskites
Tran, Fabien
- [Wien] Upgrade to WIEN2k_19.1_lapw2_error
Gavin Abo
- [Wien] spin-orbit (PBE and mBJ) for perovskites
Peter Blaha
- [Wien] spin-orbit (PBE and mBJ) for perovskites
Tran, Fabien
- [Wien] Fwd: Upgrade to WIEN2k_19.1_lapw2_error
Ashwani Kumar
- [Wien] spin-orbit (PBE and mBJ) for perovskites
Peter Blaha
- [Wien] How to do a spin polarized calculation from a non spin spolarized calculation ?
Abderrahmane Reggad
- [Wien] lapw2 crashed error
Peeyush kumar kamlesh
- [Wien] DFT-D4
Wien2k User
- [Wien] DFT-D4
Gavin Abo
- [Wien] DFT-D4
Tran, Fabien
- [Wien] DFT-D4
Wien2k User
- [Wien] Band structure calculation
Santanu Pathak
- [Wien] spin-orbit (PBE and mBJ) for perovskites
Mikhail Nestoklon
- [Wien] spin-orbit (PBE and mBJ) for perovskites
Peter Blaha
- [Wien] error in elastic constants
prasad jayasena
- [Wien] spin-orbit (PBE and mBJ) for perovskites
Mikhail Nestoklon
- [Wien] Band structure calculation
Gavin Abo
- [Wien] spin-orbit (PBE and mBJ) for perovskites
Peter Blaha
- [Wien] error in elastic constants
Peter Blaha
- [Wien] spin-orbit (PBE and mBJ) for perovskites
Mikhail Nestoklon
- [Wien] lapw2 crashed error
Gavin Abo
- [Wien] In which approach the magnetism is treated in the Wien2k Code ?
Abderrahmane Reggad
- [Wien] Your spheres are unphsically small Error
Ashwani Kumar
- [Wien] Your spheres are unphsically small Error
Laurence Marks
- [Wien] All cpus are not running for a single calculation
shamik chakrabarti
- [Wien] All cpus are not running for a single calculation
Peter Blaha
- [Wien] Fermi broadening and optics
Igor I Mazin
- [Wien] more on LAPW2 weight and Fermi
Igor I Mazin
- [Wien] more on LAPW2 weight and Fermi
Laurence Marks
- [Wien] Your spheres are unphsically small Error
Ashwani Kumar
- [Wien] Your spheres are unphsically small Error
Laurence Marks
- [Wien] All cpus are not running for a single calculation
shamik chakrabarti
- [Wien] All cpus are not running for a single calculation
Gavin Abo
- [Wien] 24k points on 36processors ??. (a Fractional k-point per core)
Ashwani Kumar
- [Wien] 24k points on 36processors ??. (a Fractional k-point per core)
Pavel Ondračka
- [Wien] 24k points on 36processors ??. (a Fractional k-point per core)
Ashwani Kumar
- [Wien] Wien2k 19.1 with linux+gfortran benchmarks
Hemza
- [Wien] more on LAPW2 weight and Fermi
Peter Blaha
- [Wien] 24k points on 36processors ??. (a Fractional k-point per core)
Pavel Ondračka
- [Wien] Wien2k 19.1 with linux+gfortran benchmarks
Peter Blaha
- [Wien] Wien2k 19.1 with linux+gfortran benchmarks
Pavel Ondračka
- [Wien] Wien2k 19.1 with linux+gfortran benchmarks
Hemza
- [Wien] In which approach the magnetism is treated in the Wien2k Code ?
pieper
- [Wien] lapw0 compilation give errors
Wahid Kamal
- [Wien] lapw0 compilation give errors
Tran, Fabien
- [Wien] lapw0 compilation give errors
Tran, Fabien
- [Wien] lapw0 compilation give errors
Wien2k User
- [Wien] x symmetso error
Riyajul Islam
- [Wien] Error in Bandstructure with hf
Tran, Fabien
- [Wien] Error in Bandstructure with hf
Peeyush kumar kamlesh
- [Wien] Error in Bandstructure with hf
Peeyush kumar kamlesh
- [Wien] Error in Bandstructure with hf
Tran, Fabien
- [Wien] Error in Bandstructure with hf
Peeyush kumar kamlesh
- [Wien] x symmetso error
pieper
- [Wien] x symmetso error
Riyajul Islam
- [Wien] Error in Bandstructure with hf
Peeyush kumar kamlesh
- [Wien] Effective Mass of Hole calculation
AJAY SINGH VERMA
- [Wien] Effective Mass of Hole calculation
Gavin Abo
- [Wien] Fwd: Fwd: Band Edge position
Subhasis Panda
- [Wien] Fragmented RAM slowdown of lapw1_mpi
Laurence Marks
- [Wien] Fwd: Fwd: Band Edge position
Peter Blaha
- [Wien] Fwd: Fwd: Band Edge position
Gavin Abo
- [Wien] Step by step method to run BoltzTrap for calculating electronic conductivity
shamik chakrabarti
- [Wien] Fragmented RAM slowdown of lapw1_mpi
Laurence Marks
- [Wien] Step by step method to run BoltzTrap for calculating electronic conductivity
Gavin Abo
- [Wien] Step by step method to run BoltzTrap for calculating electronic conductivity
shamik chakrabarti
- [Wien] Fwd: Fwd: Band Edge position
Peter Blaha
- [Wien] Fwd: Fwd: Band Edge position
Subhasis Panda
- [Wien] Band gap calculation
Peeyush kumar kamlesh
- [Wien] Band gap calculation
Gavin Abo
- [Wien] Band gap calculation
Peeyush kumar kamlesh
- [Wien] Band gap calculation
Gavin Abo
- [Wien] Band gap calculation
Gavin Abo
- [Wien] Band gap calculation
Peter Blaha
- [Wien] Band gap calculation
Peeyush kumar kamlesh
- [Wien] Band gap calculation
Peeyush kumar kamlesh
- [Wien] Kpoint unit in the wien2k band structure
Aamir Shafique
- [Wien] Kpoint unit in the wien2k band structure
Gavin Abo
- [Wien] Kpoint unit in the wien2k band structure
Oleg Rubel
- [Wien] Kpoint unit in the wien2k band structure
Aamir Shafique
- [Wien] Kpoint unit in the wien2k band structure
Gavin Abo
- [Wien] Band gap calculation
Gavin Abo
- [Wien] Accept and Deny in w2web configuration
Martin Kroeker
- [Wien] Ghost band error found in LAPW2
Peter Blaha
- [Wien] Accept and Deny in w2web configuration
Peter Blaha
- [Wien] polarisation of non magnetic compounds
Wien2k User
- [Wien] polarisation of non magnetic compounds
Rubel, Oleg
- [Wien] polarisation of non magnetic compounds
Wien2k User
- [Wien] polarisation of non magnetic compounds
Rubel, Oleg
- [Wien] help detailed installation documentation for WIEN2k
杨宇光
- [Wien] mBJ with DFT-D3
Wien2k User
- [Wien] help detailed installation documentation for WIEN2k
Gavin Abo
- [Wien] mBJ with DFT-D3
Tran, Fabien
Last message date:
Tue Dec 31 09:05:47 CET 2019
Archived on: Tue Dec 31 09:05:50 CET 2019
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