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• [Pw_forum] units of q-vectors when performing the ph.x command Elie Moujaes
  • [Pw_forum] units of q-vectors when performing the ph.x command Stefano de Gironcoli
• [Pw_forum] KPOINTS bhabya sahoo
  • [Pw_forum] Fwd: KPOINTS bhabya sahoo
  • [Pw_forum] KPOINTS sreekar guddeti
• [Pw_forum] Fermi energy in DOS calculation Tram Bui
  • [Pw_forum] Fermi energy in DOS calculation Paolo Giannozzi
• [Pw_forum] specifying angles in QE Johannes Kreutzer
  • [Pw_forum] specifying angles in QE Максим Попов
  • [Pw_forum] specifying angles in QE jinxi
• [Pw_forum] PAW-pseudo potential in splittet phonon calculation Thomas Gruber
• [Pw_forum] constrained magnetization calculation to converge at the ferromagnetic state sreekar guddeti
  • [Pw_forum] constrained magnetization calculation to converge at the ferromagnetic state Arles V. Gil Rebaza
  • [Pw_forum] constrained magnetization calculation to converge at the ferromagnetic state Gabriele Sclauzero
  • [Pw_forum] constrained magnetization calculation to converge at the ferromagnetic state sreekar guddeti
• [Pw_forum] convergence w.r.t ecutwfc Amin Torabi
  • [Pw_forum] convergence w.r.t ecutwfc Amin Torabi
  • [Pw_forum] convergence w.r.t ecutwfc mohnish pandey
  • [Pw_forum] convergence w.r.t ecutwfc Amin Torabi
• [Pw_forum] vdW functional in Quantum-Espresso WF
• [Pw_forum] Does SOC conflict with HSE06? lilonghua
  • [Pw_forum] Does SOC conflict with HSE06? Paolo Giannozzi
  • [Pw_forum] Does SOC conflict with HSE06? Paolo Giannozzi
  • [Pw_forum] Does SOC conflict with HSE06? lilonghua
• [Pw_forum] phonon with LSDA+U hanghui chen
  • [Pw_forum] phonon with LSDA+U Matteo Cococcioni
• [Pw_forum] phonon instability bhabya sahoo
  • [Pw_forum] phonon instability Stefano Baroni
  • [Pw_forum] Fwd: phonon instability bhabya sahoo
  • [Pw_forum] phonon instability Mike Mehl
  • [Pw_forum] phonon instability bhabya sahoo
  • [Pw_forum] phonon instability Mike Mehl
  • [Pw_forum] phonon instability bhabya sahoo
  • [Pw_forum] phonon instability Mike Mehl
  • [Pw_forum] phonon instability bhabya sahoo
  • [Pw_forum] phonon instability GAO Zhe
  • [Pw_forum] phonon instability Stefano Baroni
  • [Pw_forum] phonon instability GAO Zhe
• [Pw_forum] B3LYP hybrid density functional ali ghafari
  • [Pw_forum] B3LYP hybrid density functional Layla Martin-Samos
• [Pw_forum] bulk modulus bhabya sahoo
  • [Pw_forum] bulk modulus Stefano Baroni
  • [Pw_forum] bulk modulus bhabya sahoo
  • [Pw_forum] bulk modulus Mohsen Modaresi
  • [Pw_forum] bulk modulus Halima Zaari
  • [Pw_forum] bulk modulus Stefano Baroni
• [Pw_forum] partial band structure bhabya sahoo
  • [Pw_forum] partial band structure GAO Zhe
• [Pw_forum] usage of recover=.true. (solved) Elie Moujaes
• [Pw_forum] Phonon Calculations: partial results Antonio
  • [Pw_forum] Phonon Calculations: partial results lfhuang
• [Pw_forum] Can not find minimum free energy by QHA GAO Zhe
  • [Pw_forum] Can not find minimum free energy by QHA Paolo Giannozzi
  • [Pw_forum] Can not find minimum free energy by QHA GAO Zhe
• [Pw_forum] K-point in phonon calculation Lo_wan_2005XW
  • [Pw_forum] K-point in phonon calculation 程迎春
• [Pw_forum] Serial algorithm Ramesh Kumar
  • [Pw_forum] Serial algorithm Paolo Giannozzi
  • [Pw_forum] Serial algorithm Ramesh Kumar
  • [Pw_forum] Serial algorithm Paolo Giannozzi
  • [Pw_forum] Serial algorithm Ramesh Kumar
  • [Pw_forum] Postdoctoral position at the University of South Florida Sergey Lisenkov
• [Pw_forum] discrepancies in tests Jose Luis Gordillo Ruiz
  • [Pw_forum] discrepancies in tests Paolo Giannozzi
• [Pw_forum] usage of recover=.true. Elie Moujaes
  • [Pw_forum] usage of recover=.true. Elie Moujaes
  • [Pw_forum] usage of recover=.true. Changru Ma
  • [Pw_forum] usage of recover=.true. Elie Moujaes
  • [Pw_forum] usage of recover=.true. Changru Ma
  • [Pw_forum] usage of recover=.true. GAO Zhe
  • [Pw_forum] usage of recover=.true. Elie Moujaes
  • [Pw_forum] usage of recover=.true. Gabriele Sclauzero
  • [Pw_forum] usage of recover=.true. GAO Zhe
• [Pw_forum] LDA_U, species not in the list Vi Vo
  • [Pw_forum] LDA_U, species not in the list Matteo Cococcioni
• [Pw_forum] Slab relaxation with constrained atoms Christopher Heard
  • [Pw_forum] Slab relaxation with constrained atoms isaac motochi
  • [Pw_forum] Slab relaxation with constrained atoms Christopher Heard
  • [Pw_forum] Slab relaxation with constrained atoms isaac motochi
• [Pw_forum] How to nscf with LDA+U Vi Vo
  • [Pw_forum] How to nscf with LDA+U Matteo Cococcioni
• [Pw_forum] Smearing the occupations or not? Abolore Musari
  • [Pw_forum] Smearing the occupations or not? Abolore Musari
  • [Pw_forum] Smearing the occupations or not? Ari P Seitsonen
• [Pw_forum] Ce pseudo potential Vi Vo
• [Pw_forum] Pw_forum Digest, Vol 50, Issue 43 mashiat alaaii
• [Pw_forum] experimental Dit values versus DFT values mashiat alaaii
  • [Pw_forum] experimental Dit values versus DFT values Duy Le
  • [Pw_forum] experimental Dit values versus DFT values Gabriele Sclauzero
  • [Pw_forum] experimental Dit values versus DFT values [email protected]
• [Pw_forum] warning for 176 P63/m structure Lo_wan_2005XW
  • [Pw_forum] warning for 176 P63/m structure Stefano de Gironcoli
• [Pw_forum] Thermal conductivity and Gruneisen parameters Payam Norouzzadeh
  • [Pw_forum] Thermal conductivity and Gruneisen parameters Nicola Marzari
  • [Pw_forum] Re : Thermal conductivity and Gruneisen parameters Bertrand SITAMTZE
  • [Pw_forum] Re : Thermal conductivity and Gruneisen parameters Stefano Baroni
  • [Pw_forum] Re : Thermal conductivity and Gruneisen parameters Bertrand SITAMTZE
  • [Pw_forum] Re : Thermal conductivity and Gruneisen parameters Stefano Baroni
• [Pw_forum] Calculation of surface and nanowire elastic constant KORIR KIPRONOH
• [Pw_forum] QHA bhabya sahoo
  • [Pw_forum] QHA Sanjeev Gupta
  • [Pw_forum] QHA henry odhiambo
  • [Pw_forum] QHA Uri Argaman
• [Pw_forum] experimental Dit and theoretical Dit mashiat alaaii
• [Pw_forum] Temperature rescaling in MD calculation (DONG Rui) Antonio Tilocca
• [Pw_forum] problem in electronic structure of ZnO zafar rasheed
  • [Pw_forum] problem in electronic structure of ZnO Arles V. Gil Rebaza
  • [Pw_forum] problem in electronic structure of ZnO zafar rasheed
• [Pw_forum] band structure bhabya sahoo
  • [Pw_forum] band structure bhabya sahoo
• [Pw_forum] Strange bandstructure for metallic carbon nanotube chengyu yang
  • [Pw_forum] Strange bandstructure for metallic carbon nanotube chengyu yang
• [Pw_forum] Temperature rescaling in MD calculation DONG Rui
  • [Pw_forum] Temperature rescaling in MD calculation Changru Ma
• [Pw_forum] WAN90_example failed in library mode lilonghua
  • [Pw_forum] WAN90_example failed in library mode Nicola Marzari
  • [Pw_forum] problem with bands.x ver. 4.3.1 [email protected]
  • [Pw_forum] problem with bands.x ver. 4.3.1 mike at.
• [Pw_forum] symmetry not found in pw.x and ph.x Riping WANG
  • [Pw_forum] symmetry not found in pw.x and ph.x Paolo Giannozzi
• [Pw_forum] phonon calculations for a system of 60 atoms Elie Moujaes
• [Pw_forum] Problem in Xspectra calculation Niharika Joshi
  • [Pw_forum] Problem in Xspectra calculation mohnish pandey
  • [Pw_forum] Problem in Xspectra calculation Paolo Giannozzi
  • [Pw_forum] Problem in Xspectra calculation isaac motochi
• [Pw_forum] Convergence of Phonon with K points mayank gupta
  • [Pw_forum] Convergence of Phonon with K points Prasenjit Ghosh
  • [Pw_forum] Convergence of Phonon with K points Stefano Baroni
  • [Pw_forum] Convergence of Phonon with K points Prasenjit Ghosh
• [Pw_forum] Calculation of log_w davgumo
• [Pw_forum] Fermi Energy Mahdi Faqieh nasiri
  • [Pw_forum] Fermi Energy chengyu yang
  • [Pw_forum] Fermi energy Sakhrawi Taoufek
  • [Pw_forum] Fermi energy Guido Fratesi
  • [Pw_forum] Fermi Energy mohaddeseh abbasnejad
  • [Pw_forum] Fermi Energy Paolo Giannozzi
  • [Pw_forum] fermi energy david foster
  • [Pw_forum] fermi energy Giuseppe Mattioli
  • [Pw_forum] fermi energy david
  • [Pw_forum] fermi energy david
  • [Pw_forum] Fermi energy DELLACA' Valentina (CRF)
  • [Pw_forum] Fermi energy Giuseppe Mattioli
  • [Pw_forum] R: Fermi energy DELLACA' Valentina (CRF)
  • [Pw_forum] R: Fermi energy DELLACA' Valentina (CRF)
• [Pw_forum] Compilation QE4.3.1 under Cygwin (gcc, g++4.6.1) beata_bp Gazeta.pl
  • [Pw_forum] Compilation QE4.3.1 under Cygwin (gcc, g++4.6.1) Lorenzo Paulatto
  • [Pw_forum] Compilation QE4.3.1 under Cygwin (gcc, g++4.6.1) beata_bp Gazeta.pl
• [Pw_forum] convergence of Phonon mayank gupta
  • [Pw_forum] convergence of Phonon GAO Zhe
  • [Pw_forum] convergence of Phonon Stefano Baroni
• [Pw_forum] Pd pseudopotential Christopher Heard
  • [Pw_forum] Pd pseudopotential Lorenzo Paulatto
• [Pw_forum] Co Pseudopotential Izaak Williamson
  • [Pw_forum] Co Pseudopotential heather kulik
  • [Pw_forum] Co Pseudopotential Izaak Williamson
  • [Pw_forum] Co Pseudopotential heather kulik
  • [Pw_forum] Co Pseudopotential jia chen
  • [Pw_forum] Co Pseudopotential [email protected]
  • [Pw_forum] Co Pseudopotential jia chen
  • [Pw_forum] Co Pseudopotential Izaak Williamson
• [Pw_forum] the meaning of gx, gy and gz in PDOS of phonon from QHA code GAO Zhe
• [Pw_forum] QE v4.3.2 failed to read the input file of v4.3 lilonghua
  • [Pw_forum] QE v4.3.2 failed to read the input file of v4.3 lilonghua
  • [Pw_forum] QE v4.3.2 failed to read the input file of v4.3 Layla Martin-Samos
  • [Pw_forum] QE v4.3.2 failed to read the input file of v4.3 Jörg Buchwald
  • [Pw_forum] QE v4.3.2 failed to read the input file of v4.3 Layla Martin-Samos
  • [Pw_forum] QE v4.3.2 failed to read the input file of v4.3 Jörg Buchwald
  • [Pw_forum] QE v4.3.2 failed to read the input file of v4.3 Layla Martin-Samos
  • [Pw_forum] QE v4.3.2 failed to read the input file of v4.3 Jörg Buchwald
  • [Pw_forum] QE v4.3.2 failed to read the input file of v4.3 lilonghua
  • [Pw_forum] QE v4.3.2 failed to read the input file of v4.3 Layla Martin-Samos
• [Pw_forum] elastic constants bhabya sahoo
  • [Pw_forum] elastic constants Stefano Baroni
  • [Pw_forum] elastic constants bhabya sahoo
  • [Pw_forum] elastic constants GAO Zhe
  • [Pw_forum] elastic constants bhabya sahoo
  • [Pw_forum] Elastic Constants henry odhiambo
  • [Pw_forum] Elastic Constants mohnish pandey
  • [Pw_forum] Elastic Constants Nicola Marzari
  • [Pw_forum] Elastic Constants Ben Palmer
  • [Pw_forum] Elastic Constants Mohsen Modaresi
  • [Pw_forum] Elastic Constants Ben Palmer
• [Pw_forum] Invitation to connect on LinkedIn Alex An via LinkedIn
  • [Pw_forum] Invitation to connect on LinkedIn Alex An via LinkedIn
  • [Pw_forum] Invitation to connect on LinkedIn Thaneshwor Kaloni via LinkedIn
  • [Pw_forum] Invitation to connect on LinkedIn Stefano Baroni
  • [Pw_forum] Invitation to connect on LinkedIn Mehrnoosh Hazrati via LinkedIn
  • [Pw_forum] Invitation to connect on LinkedIn Stefano Baroni
  • [Pw_forum] Invitation to connect on LinkedIn Thaneshwor Kaloni via LinkedIn
  • [Pw_forum] Invitation to connect on LinkedIn Sanjeev Gupta
• [Pw_forum] Help regarding supercell (Deepak Tahkur) ramesh kumar
• [Pw_forum] repeated band structure calculation in, splittet phonon calculation Thomas Gruber
• [Pw_forum] Help regarding supercell dipak thakur
  • [Pw_forum] Help regarding supercell Duy Le
• [Pw_forum] Error in example22 Padmaja Patnaik
  • [Pw_forum] Error in example22 Gabriele Sclauzero
  • [Pw_forum] Error in example22 Padmaja Patnaik
  • [Pw_forum] Error in example22 Gabriele Sclauzero
• [Pw_forum] pw.x seg. faults with EXX Omololu Akin-Ojo
  • [Pw_forum] pw.x seg. faults with EXX Omololu Akin-Ojo

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