August 2020 Archives by author

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Starting: Wed Aug 5 21:20:54 CEST 2020
Ending: Mon Aug 31 21:09:46 CEST 2020
Messages: 99

• [Wien] optimization vs experiment   Gavin Abo
• [Wien] Calculating x kram with intra-band contribution   Gavin Abo
• [Wien] Calculating x kram with intra-band contribution   Gavin Abo
• [Wien] Lattice thermal conductivity   Gavin Abo
• [Wien] Error during abc & gamma (4D) optimization of a monoclinic system   Gavin Abo
• [Wien] Error during abc & gamma (4D) optimization of a monoclinic system   Gavin Abo
• [Wien] Error during abc & gamma (4D) optimization of a monoclinic system   Gavin Abo
• [Wien] Energy in SCF NOT CONVERGED   Serhat Ayık
• [Wien] Born charges with hybrids?   Peter Blaha
• [Wien] Wien post from pascal.boulet at univ-amu.fr   Peter Blaha
• [Wien] Simultaeneous optimization of atomic coordinates with lattice parameters   Peter Blaha
• [Wien] Wien post from pascal.boulet at univ-amu.fr (Errors with DGEMM and hybrid calculations)   Peter Blaha
• [Wien] Energy in SCF NOT CONVERGED   Peter Blaha
• [Wien] how to increase the band gap with TB-MBJ or other potential   Peter Blaha
• [Wien] Interstitial DOS for SOC calculation   Peter Blaha
• [Wien] Berrypi & w2w   Peter Blaha
• [Wien] Continued: Error during abc & gamma (4D) optimization of a monoclinic system   Peter Blaha
• [Wien] omp vs mpi for LAPW1   Peter Blaha
• [Wien] omp vs mpi for LAPW1   Peter Blaha
• [Wien] Ghost band error in anatase TiO2   Peter Blaha
• [Wien] dstart.error   Peter Blaha
• [Wien] join_vectorfiles to be used with a different syntax   Peter Blaha
• [Wien] Interstitial DOS for SOC calculation   Falke, Johannes
• [Wien] Born charges with hybrids?   Fecher, Gerhard
• [Wien] Born charges with hybrids?   Fecher, Gerhard
• [Wien] join_vectorfiles to be used with a different syntax   Luc Fruchter
• [Wien] Error in Parallel LAPW1 during mBJ calculations   Peeyush Kumar Kamlesh
• [Wien] Error in Parallel LAPW1 during mBJ calculations   Peeyush Kumar Kamlesh
• [Wien] Lattice thermal conductivity   Peeyush Kumar Kamlesh
• [Wien] Lattice thermal conductivity   Peeyush Kumar Kamlesh
• [Wien] Core frozen during scf   Laurence Marks
• [Wien] Born charges with hybrids?   Laurence Marks
• [Wien] Simultaeneous optimization of atomic coordinates with lattice parameters   Laurence Marks
• [Wien] Simultaeneous optimization of atomic coordinates with lattice parameters   Laurence Marks
• [Wien] Wien post from pascal.boulet at univ-amu.fr (Errors with DGEMM and hybrid calculations)   Laurence Marks
• [Wien] Wien post from pascal.boulet at univ-amu.fr (Errors with DGEMM and hybrid calculations)   Laurence Marks
• [Wien] Error during abc & gamma (4D) optimization of a monoclinic system   Laurence Marks
• [Wien] Berrypi & w2w   Laurence Marks
• [Wien] Error in SCF calculation   Laurence Marks
• [Wien] omp vs mpi for LAPW1   Laurence Marks
• [Wien] Error in SCF calculation   Laurence Marks
• [Wien] Ghost band error in anatase TiO2   Laurence Marks
• [Wien] Calculating x kram with intra-band contribution   Chukwuemeka Okoye
• [Wien] Calculating x kram with intra-band contribution   Chukwuemeka Okoye
• [Wien] Calculating x kram with intra-band contribution   Chukwuemeka Okoye
• [Wien] Calculating x kram with intra-band contribution   Chukwuemeka Okoye
• [Wien] Calculating x kram with intra-band contribution   Chukwuemeka Okoye
• [Wien] Calculating x kram with intra-band contribution   Chukwuemeka Okoye
• [Wien] Energy in SCF NOT CONVERGED   Sanjay Pachori
• [Wien] how to increase the band gap with TB-MBJ or other potential   Sanjay Pachori
• [Wien] how to increase the band gap with TB-MBJ or other potential   Sanjay Pachori
• [Wien] Energy in SCF NOT CONVERGED   Sanjay Pachori
• [Wien] how to increase the band gap with TB-MBJ or other potential   Sanjay Pachori
• [Wien] Python script   Subhasis Panda
• [Wien] omp vs mpi for LAPW1   karima Physique
• [Wien] omp vs mpi for LAPW1   karima Physique
• [Wien] omp vs mpi for LAPW1   karima Physique
• [Wien] Error in SCF calculation   upasana Rani
• [Wien] Error in SCF calculation   upasana Rani
• [Wien] Error in SCF calculation   upasana Rani
• [Wien] Berrypi & w2w   Rubel, Oleg
• [Wien] Berrypi & w2w   Rubel, Oleg
• [Wien] Test-Mail   Ruh, Thomas
• [Wien] Compiling WIEN2k with AOCL for AMD processors   Ruh, Thomas
• [Wien] Core frozen during scf   Shamim Sk
• [Wien] Compiling WIEN2k with AOCL for AMD processors   Artem Tarasov
• [Wien] DFT calculation of a Bio-molecule   Tran, Fabien
• [Wien] Calculating x kram with intra-band contribution   Tran, Fabien
• [Wien] Calculating x kram with intra-band contribution   Tran, Fabien
• [Wien] Calculating x kram with intra-band contribution   Tran, Fabien
• [Wien] Calculating x kram with intra-band contribution   Tran, Fabien
• [Wien] Query about SCAN+rVV10   Tran, Fabien
• [Wien] Query about SCAN+rVV10   Tran, Fabien
• [Wien] Wien post from pascal.boulet at univ-amu.fr (Errors with DGEMM and hybrid calculations)   Tran, Fabien
• [Wien] Wien post from pascal.boulet at univ-amu.fr (Errors with DGEMM and hybrid calculations)   Tran, Fabien
• [Wien] Wien post from pascal.boulet at univ-amu.fr (Errors with DGEMM and hybrid calculations)   Tran, Fabien
• [Wien] Wien post from pascal.boulet at univ-amu.fr (Errors with DGEMM and hybrid calculations)   Tran, Fabien
• [Wien] Error in Parallel LAPW1 during mBJ calculations   Tran, Fabien
• [Wien] how to increase the band gap with TB-MBJ or other potential   Tran, Fabien
• [Wien] DFT calculation of a Bio-molecule   AJAY SINGH VERMA
• [Wien] Query about SCAN+rVV10   shamik chakrabarti
• [Wien] Query about SCAN+rVV10   shamik chakrabarti
• [Wien] Query about SCAN+rVV10   shamik chakrabarti
• [Wien] Simultaeneous optimization of atomic coordinates with lattice parameters   shamik chakrabarti
• [Wien] Simultaeneous optimization of atomic coordinates with lattice parameters   shamik chakrabarti
• [Wien] Simultaeneous optimization of atomic coordinates with lattice parameters   shamik chakrabarti
• [Wien] Simultaeneous optimization of atomic coordinates with lattice parameters   shamik chakrabarti
• [Wien] Error during abc & gamma (4D) optimization of a monoclinic system   shamik chakrabarti
• [Wien] Error during abc & gamma (4D) optimization of a monoclinic system   shamik chakrabarti
• [Wien] Error during abc & gamma (4D) optimization of a monoclinic system   shamik chakrabarti
• [Wien] Error during abc & gamma (4D) optimization of a monoclinic system   shamik chakrabarti
• [Wien] Continued: Error during abc & gamma (4D) optimization of a monoclinic system   shamik chakrabarti
• [Wien] Continued: Error during abc & gamma (4D) optimization of a monoclinic system   shamik chakrabarti
• [Wien] Error during abc & gamma (4D) optimization of a monoclinic system   shamik chakrabarti
• [Wien] Ghost band error in anatase TiO2   shamik chakrabarti
• [Wien] Wien post from pascal.boulet at univ-amu.fr (Errors with DGEMM and hybrid calculations)   pboulet
• [Wien] Wien post from pascal.boulet at univ-amu.fr (Errors with DGEMM and hybrid calculations)   pboulet
• [Wien] optimization reliability   tarek
• [Wien] optimization vs experiment   tarek

Last message date: Mon Aug 31 21:09:46 CEST 2020
Archived on: Mon Aug 31 21:09:52 CEST 2020

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