April 2025 Archives by author

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Starting: Tue Apr 1 16:23:45 CEST 2025
Ending: Wed Apr 30 15:29:21 CEST 2025
Messages: 68

[QE-users] [SPAM] Electron-phonon coulpiong with Hubbard U 308481662
[QE-users] [SPAM] Re: Electron-phonon coulpiong with Hubbard U 308481662
[QE-users] Compatibility of lelfield = .true. with PAW Pseudopotentials Minsung An
[QE-users] Units of velocity Annam, Roshan Sameer
[QE-users] Issue when running phonon calculations with ph.x (qe.7.3.1) H. BOUAFIA
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Stefano Baroni
[QE-users] importexport_binary.x executable missing in latest QE versions Yuvam Bhateja
[QE-users] importexport_binary.x executable missing in latest QE versions Yuvam Bhateja
[QE-users] Paris International School on Advanced Computational Materials Science (PISACMS), August 2025 Ari Paavo SEITSONEN / CNRS
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Giovanni Cantele
[QE-users] Help in spin polarized calculation for surface dangling bonds Giovanni Cantele
[QE-users] Help in spin polarized calculation for surface dangling bonds Giovanni Cantele
[QE-users] Vacuum potential after using assume isolated= 2d NILOTPAL DEKA
[QE-users] Regarding not saving .xml in tmp directory BINOY CHANDRA DEY
[QE-users] Test-suite failing QE-7.4.1 Pietro Davide Delugas
[QE-users] Test-suite failing QE-7.4.1 Pietro Davide Delugas
[QE-users] QE crashes with non-local functionals Pietro Davide Delugas
[QE-users] Test-suite failing QE-7.4.1 Pietro Davide Delugas
[QE-users] Test-suite failing QE-7.4.1 Pietro Davide Delugas
[QE-users] Test-suite failing QE-7.4.1 Ian Dunn
[QE-users] Test-suite failing QE-7.4.1 Ian Dunn
[QE-users] Test-suite failing QE-7.4.1 Ian Dunn
[QE-users] Test-suite failures with parallel QE Ian Dunn
[QE-users] Correct symmetry setup NaCl Ian Dunn
[QE-users] QE-GPU Holger Euchner
[QE-users] Test-suite failing QE-7.4.1 Paolo Giannozzi
[QE-users] importexport_binary.x executable missing in latest QE versions Paolo Giannozzi
[QE-users] Test-suite failures with parallel QE Paolo Giannozzi
[QE-users] QE crashes with non-local functionals Paolo Giannozzi
[QE-users] importexport_binary.x executable missing in latest QE versions Paolo Giannozzi
[QE-users] Test-suite failing QE-7.4.1 Paolo Giannozzi
[QE-users] Regarding not saving .xml in tmp directory Paolo Giannozzi
[QE-users] bfgs failed after 25 scf cycles and 23 bfgs steps, convergence not achieved Paolo Giannozzi
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Stefano de Gironcoli
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Stefano de Gironcoli
[QE-users] Meaning of three G vectors sets Stefano de Gironcoli
[QE-users] Problem with mBJ (tb09, meta-gga) calculations Sergeev Gregory
[QE-users] [SPAM] Electron-phonon coulpiong with Hubbard U Timrov Iurii
[QE-users] Incorrect Visualization of Ba₂ZrS₄ Body-Centered Tetragonal Structure in XCrySDen from Quantum ESPRESSO Input Asma Khatun
[QE-users] QE crashes with non-local functionals Nurit Manukovsky
[QE-users] QE crashes with non-local functionals Nurit Manukovsky
[QE-users] [SPAM] Incorrect Visualization of Ba₂ZrS₄ Body-Centered Tetragonal Structure in XCrySDen from Quantum ESPRESSO Input Husak Michal
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Kazume NISHIDATE
[QE-users] bfgs failed after 25 scf cycles and 23 bfgs steps, convergence not achieved Barsha Pal
[QE-users] users Digest, Vol 213, Issue 23 Barsha Pal
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Shubham Patel
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Shubham Patel
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Shubham Patel
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Shubham Patel
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Shubham Patel
[QE-users] unit mismatch between PH generated frequencies and manually generated eigenvalues Shubham Patel
[QE-users] Meaning of three G vectors sets Lorenzo Paulatto
[QE-users] bfgs failed after 25 scf cycles and 23 bfgs steps, convergence not achieved Lorenzo Paulatto
[QE-users] Request for resolving my issue Danish Raaza
[QE-users] Test-suite failing QE-7.4.1 Giacomo De Santis
[QE-users] Test-suite failing QE-7.4.1 Giacomo De Santis
[QE-users] Test-suite failing QE-7.4.1 Giacomo De Santis
[QE-users] Help in spin polarized calculation for surface dangling bonds Lorenzo Sponza
[QE-users] Help in spin polarized calculation for surface dangling bonds Lorenzo Sponza
[QE-users] Meaning of three G vectors sets Lorenzo Sponza
[QE-users] QE and BoltzTraP2 " inconsistent set of k points "erroe YOSHIZAKI Takashi
[QE-users] Raman intensity can not display LIANG Xiongyi
[QE-users] Charge density difference calculation owais farooq
[QE-users] Regarding unit conversion for polarisation from C/m2 to C/m jkmodi22
[QE-users] Error in NEB calculation: BAD TERMINATION OF ONE OF YOUR APPLICATION PROCESSES jkmodi22
[QE-users] which dispersion correction works for spinorbit ? milias
[QE-users] [QE-user Stress tensor result difference between qe and vasp np_wangyi
[QE-users] self_energy_storage.f90: warning #5462: Global name too long 孙家法

Last message date: Wed Apr 30 15:29:21 CEST 2025
Archived on: Wed Apr 30 15:21:44 CEST 2025

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