June 2019 Archives by thread

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Starting: Mon Jun 3 10:45:01 CEST 2019
Ending: Sun Jun 30 15:15:06 CEST 2019
Messages: 94

• [Wien] Can someone share the MPI parallel script using on LSF job management system with me ?   踢球者
  • [Wien] Can someone share the MPI parallel script using on LSF job management system with me ?   Gavin Abo
• [Wien] Regarding Band structure error   Arvind Kumar
  • [Wien] Regarding Band structure error   Gavin Abo
    • [Wien] Regarding Band structure error   Peter Blaha
• [Wien] Few questions about initialization   Dr. K. C. Bhamu
  • [Wien] Few questions about initialization   tran at theochem.tuwien.ac.at
    • [Wien] Few questions about initialization   Dr. K. C. Bhamu
• [Wien] Super cell reg-LiMn2O4   Murugan Sundareswari
  • [Wien] Super cell reg-LiMn2O4   delamora
    • [Wien] Super cell reg-LiMn2O4   delamora
      • [Wien] Super cell reg-LiMn2O4   delamora
      • [Wien] Super cell reg-LiMn2O4   delamora
• [Wien] bibtex format of wien2k   Subrata Jana
  • [Wien] bibtex format of wien2k   tran at theochem.tuwien.ac.at
• [Wien] ERROR forrtl: severe (24) end of file   Ashwani Kumar
  • [Wien] ERROR forrtl: severe (24) end of file   Dr. K. C. Bhamu
  • [Wien] ERROR forrtl: severe (24) end of file   Ashwani Kumar
• [Wien] Convergence test for MBJ potential.   Bikash Patra
  • [Wien] Convergence test for MBJ potential.   tran at theochem.tuwien.ac.at
    • [Wien] Convergence test for MBJ potential.   Bikash Patra
      • [Wien] Convergence test for MBJ potential.   tran at theochem.tuwien.ac.at
• [Wien] Where am I making mistake in LDA+U MAE calculation   Tuvshin D
  • [Wien] Where am I making mistake in LDA+U MAE calculation   Peter Blaha
    • [Wien] [EXTERNAL] Re: Where am I making mistake in LDA+U MAE calculation   Parker, David S.
    • [Wien] Where am I making mistake in LDA+U MAE calculation   Tuvshin D
      • [Wien] Where am I making mistake in LDA+U MAE calculation   tran at theochem.tuwien.ac.at
      • [Wien] Where am I making mistake in LDA+U MAE calculation   Tuvshin D
      • [Wien] Where am I making mistake in LDA+U MAE calculation   Ahmad Asali
      • [Wien] [EXTERNAL] Re: Where am I making mistake in LDA+U MAE calculation   Parker, David S.
• [Wien] LSDA+U+SOC energy problem   杨柯
  • [Wien] LSDA+U+SOC energy problem   tran at theochem.tuwien.ac.at
• [Wien] WIEN2k Version 19.1   Peter Blaha
  • [Wien] WIEN2k Version 19.1   Gavin Abo
    • [Wien] WIEN2k Version 19.1   Peter Blaha
      • [Wien] WIEN2k Version 19.1   Gavin Abo
      • [Wien] WIEN2k Version 19.1   Peter Blaha
      • [Wien] WIEN2k Version 19.1   Laurence Marks
      • [Wien] WIEN2k Version 19.1   Gavin Abo
      • [Wien] WIEN2k Version 19.1   Laurence Marks
      • [Wien] WIEN2k Version 19.1   Gavin Abo
      • [Wien] WIEN2k Version 19.1   pboulet
      • [Wien] WIEN2k Version 19.1   Gavin Abo
      • [Wien] WIEN2k Version 19.1   Laurence Marks
      • [Wien] WIEN2k Version 19.1   Peter Blaha
      • [Wien] Fwd: WIEN2k Version 19.1   Kamil Klier
  • [Wien] WIEN2k 19.1 siteconfig libxc   Gavin Abo
    • [Wien] WIEN2k 19.1 siteconfig libxc   Peter Blaha
• [Wien] compiling error of lapw1_mpi   Wien2k User
  • [Wien] compiling error of lapw1_mpi   Peter Blaha
    • [Wien] compiling error of lapw1_mpi   Pavel Ondračka
      • [Wien] compiling error of lapw1_mpi   Wien2k User
      • [Wien] compiling error of lapw1_mpi   Pavel Ondračka
      • [Wien] compiling error of lapw1_mpi   Peter Blaha
      • [Wien] compiling error of lapw1_mpi   Wien2k User
• [Wien] Erro in compiling lapw0 and lapw0_mpi   Wien2k User
  • [Wien] Erro in compiling lapw0 and lapw0_mpi   Peter Blaha
• [Wien] post doc position with P.Hyldgaard (Chalmers Univ, Sweden)   Peter Blaha
• [Wien] Angle change 94.14 to 107.1 during initializing.   Ramsewak Kashyap
  • [Wien] Angle change 94.14 to 107.1 during initializing.   Peter Blaha
• [Wien] core-hole calculation in a molecule   Pavel Ondračka
  • [Wien] core-hole calculation in a molecule   Sam Trickey
  • [Wien] core-hole calculation in a molecule   Peter Blaha
    • [Wien] core-hole calculation in a molecule   Pavel Ondračka
      • [Wien] core-hole calculation in a molecule   Pavel Ondračka
• [Wien] Problems with installation of Wien2k 19.1   Israel Omar Perez Lopez
  • [Wien] Problems with installation of Wien2k 19.1   tran at theochem.tuwien.ac.at
• [Wien] LAPW1 with ELPA   Wien2k User
  • [Wien] LAPW1 with ELPA   Gavin Abo
• [Wien] new/old machines file   Wien2k User
  • [Wien] new/old machines file   Laurence Marks
    • [Wien] new/old machines file   Laurence Marks
      • [Wien] new/old machines file   Wien2k User
    • [Wien] new/old machines file   Wien2k User
• [Wien] Is calculating Knight shifts in semiconductor using WIEN2k feasible?   林敏
  • [Wien] Is calculating Knight shifts in semiconductor using WIEN2k feasible?   Peter Blaha
• [Wien] bug for PW91-correlation in wien2k_19   Peter Blaha
• [Wien] gfortran compilation and run problems for 19.1   Mikhail Nestoklon
  • [Wien] gfortran compilation and run problems for 19.1   Peter Blaha
    • [Wien] gfortran compilation and run problems for 19.1   Sam Trickey
      • [Wien] gfortran compilation and run problems for 19.1   Fecher, Gerhard
      • [Wien] gfortran compilation and run problems for 19.1   Gavin Abo
      • [Wien] gfortran compilation and run problems for 19.1   Fecher, Gerhard
      • [Wien] gfortran compilation and run problems for 19.1   Mikhail Nestoklon
      • [Wien] gfortran compilation and run problems for 19.1   Gavin Abo
    • [Wien] gfortran compilation and run problems for 19.1   Mikhail Nestoklon
      • [Wien] gfortran compilation and run problems for 19.1   Peter Blaha
• [Wien] LAPW1 segmentation fault WIEN2k.19.1   Luigi Maduro - TNW
• [Wien] problem during thermal calculations   GM RAI
  • [Wien] problem during thermal calculations   pboulet
  • [Wien] problem during thermal calculations   Dr. K. C. Bhamu
• [Wien] Bugfix for MPI-parallel lapw1 with NO linked ELPA   Ruh, Thomas
  • [Wien] core hole in high energy level   Lyudmila Dobysheva
    • [Wien] core hole in high energy level   Laurence Marks

Last message date: Sun Jun 30 15:15:06 CEST 2019
Archived on: Sun Jun 30 15:15:25 CEST 2019

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