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Messages by Date

• 2012/09/02 [Pw_forum] PAW for vdw-DF2 florence liu
• 2012/09/02 [Pw_forum] strange results for phonon frequencies. Paolo Giannozzi
• 2012/09/02 [Pw_forum] london Ari P Seitsonen
• 2012/09/02 [Pw_forum] london bf azi
• 2012/09/01 [Pw_forum] strange results for phonon frequencies. Axel Kohlmeyer
• 2012/09/01 [Pw_forum] strange results for phonon frequencies. Elie M
• 2012/08/31 [Pw_forum] Problem with Pseudopotentials and Input Information Matthew M Montemore
• 2012/08/31 [Pw_forum] Join to group , confirmation # Yue-Wen Fang
• 2012/08/31 [Pw_forum] Possible bug(?) in q2r.x when using FFT routine in ESSL Paolo Giannozzi
• 2012/08/31 [Pw_forum] Possible bug(?) in q2r.x when using FFT routine in ESSL Jiseok Kim
• 2012/08/30 [Pw_forum] kohn -sham orbitals ortogonality and ortonormality Alexey Akimov
• 2012/08/30 [Pw_forum] q-points in the phonon calculations Paolo Giannozzi
• 2012/08/30 [Pw_forum] q-points in the phonon calculations Elie M
• 2012/08/30 [Pw_forum] Memory usage by pw.x Axel Kohlmeyer
• 2012/08/30 [Pw_forum] Memory usage by pw.x Guido Fratesi
• 2012/08/30 [Pw_forum] Memory usage by pw.x Guido Fratesi
• 2012/08/30 [Pw_forum] Memory usage by pw.x Simon Binnie
• 2012/08/30 [Pw_forum] Memory usage by pw.x Lorenzo Paulatto
• 2012/08/30 [Pw_forum] Memory usage by pw.x Paolo Giannozzi
• 2012/08/30 [Pw_forum] kohn -sham orbitals ortogonality and ortonormality [email protected]
• 2012/08/30 [Pw_forum] Memory usage by pw.x Guido Fratesi
• 2012/08/30 [Pw_forum] InAs Pseudo HSE Saeedeh S Ravandi
• 2012/08/30 [Pw_forum] kohn -sham orbitals ortogonality and ortonormality Alexey Akimov
• 2012/08/30 [Pw_forum] kohn -sham orbitals ortogonality and ortonormality [email protected]
• 2012/08/29 [Pw_forum] parallel processing Paolo Giannozzi
• 2012/08/29 [Pw_forum] parallel processing somayeh fotohi
• 2012/08/29 [Pw_forum] vdw-df2 Ary Junior
• 2012/08/29 [Pw_forum] vdw-df2 florence liu
• 2012/08/29 [Pw_forum] Memory usage by pw.x Filippo Spiga
• 2012/08/29 [Pw_forum] Memory usage by pw.x Paolo Giannozzi
• 2012/08/29 [Pw_forum] Memory usage by pw.x Guido Fratesi
• 2012/08/29 [Pw_forum] Pw_forum Digest, Vol 62, Issue 50 Saeedeh S Ravandi
• 2012/08/29 [Pw_forum] kohn -sham orbitals ortogonality and ortonormality Alexey Akimov
• 2012/08/29 [Pw_forum] dapl_post_req resource ERR: dtos pending Axel Kohlmeyer
• 2012/08/29 [Pw_forum] dapl_post_req resource ERR: dtos pending Vijay Amirtharaj A
• 2012/08/29 [Pw_forum] dapl_post_req resource ERR: dtos pending Paolo Giannozzi
• 2012/08/29 [Pw_forum] dapl_post_req resource ERR: dtos pending Vijay Amirtharaj A
• 2012/08/29 [Pw_forum] confusion in ev.x karan deep
• 2012/08/29 [Pw_forum] Generation of H and O GIPAW PP Davide Ceresoli
• 2012/08/28 [Pw_forum] kohn -sham orbitals ortogonality and ortonormality [email protected]
• 2012/08/28 [Pw_forum] kohn -sham orbitals ortogonality and ortonormality Paolo Giannozzi
• 2012/08/28 [Pw_forum] kohn -sham orbitals ortogonality and ortonormality [email protected]
• 2012/08/28 [Pw_forum] Question about InAs Masoud
• 2012/08/28 [Pw_forum] kohen -sham orbitals ortogonality and ortonormality Alexey Akimov
• 2012/08/28 [Pw_forum] Generation of H and O GIPAW PP jérôme cuny
• 2012/08/28 [Pw_forum] Join to group , confirmation # Saeedeh S Ravandi
• 2012/08/28 [Pw_forum] Question about InAs Saeedeh S Ravandi
• 2012/08/28 [Pw_forum] pseudopotential for Sodium Ananya Mondal
• 2012/08/28 [Pw_forum] kohen -sham orbitals ortogonality and ortonormality [email protected]
• 2012/08/28 [Pw_forum] Generation of H and O GIPAW PP Davide Ceresoli
• 2012/08/28 [Pw_forum] differences in vdW_kernel_table Paolo Giannozzi
• 2012/08/28 [Pw_forum] Generation of H and O GIPAW PP jérôme cuny
• 2012/08/28 [Pw_forum] pseudopotential for Sodium Stefano de Gironcoli
• 2012/08/27 [Pw_forum] pseudopotential for Sodium Yue-Wen Fang
• 2012/08/27 [Pw_forum] pseudopotential for Sodium Ananya Mondal
• 2012/08/27 [Pw_forum] pseudopotential for Vdw bf azi
• 2012/08/27 [Pw_forum] pseudopotential for Sodium Ananya mondal
• 2012/08/27 [Pw_forum] question about spinors Alexey Akimov
• 2012/08/27 [Pw_forum] STM simulation Guido Fratesi
• 2012/08/27 [Pw_forum] PAW+PBE0 Layla Martin-Samos
• 2012/08/27 [Pw_forum] question about spinors Gabriele Sclauzero
• 2012/08/26 [Pw_forum] PAW+PBE0 florence liu
• 2012/08/26 [Pw_forum] STM simulation Cao TF
• 2012/08/25 [Pw_forum] Bug in QE 5.0 with ibrav=0 and using a instead of Y. L. Li
• 2012/08/24 [Pw_forum] How I can simulate charged slab with surface charge by QE yavar pour azar
• 2012/08/24 [Pw_forum] (no subject) Franklin Zhan
• 2012/08/24 [Pw_forum] question about spinors Alexey Akimov
• 2012/08/24 [Pw_forum] How I can simulate charged slab with surface charge by QE Alexey Akimov
• 2012/08/24 [Pw_forum] Negative frequencies at really low threshold convergence Stefano Baroni
• 2012/08/24 [Pw_forum] Negative frequencies at really low threshold convergence Elie M
• 2012/08/24 [Pw_forum] (no subject) Axel Kohlmeyer
• 2012/08/24 [Pw_forum] (no subject) ramzi alaya
• 2012/08/24 [Pw_forum] question about spinors Gabriele Sclauzero
• 2012/08/24 [Pw_forum] confusion in ev.x Paolo Giannozzi
• 2012/08/24 [Pw_forum] How I can simulate charged slab with surface charge by QE Paolo Giannozzi
• 2012/08/24 [Pw_forum] Negative frequencies at really low threshold convergence Paolo Giannozzi
• 2012/08/23 [Pw_forum] How to modify the input file when testing virtual crystal pseudopotential? Yue-Wen Fang
• 2012/08/23 [Pw_forum] question about spinors Alexey Akimov
• 2012/08/23 [Pw_forum] Negative frequencies at really low threshold convergence Elie M
• 2012/08/23 [Pw_forum] differences in vdW_kernel_table Eduardo Ariel Menendez Proupin
• 2012/08/23 [Pw_forum] restart flag for nmr calculation using gipaw Prasenjit Ghosh
• 2012/08/23 [Pw_forum] restart flag for nmr calculation using gipaw Davide Ceresoli
• 2012/08/22 [Pw_forum] Dipole correction of PW Fenggong Wang
• 2012/08/22 [Pw_forum] Dipole correction of PW Paolo Giannozzi
• 2012/08/22 [Pw_forum] question about spinors Paolo Giannozzi
• 2012/08/22 [Pw_forum] How I can simulate charged slab with surface charge by QE yavar pour azar
• 2012/08/22 [Pw_forum] Bug in QE 5.0 with ibrav=0 and using a instead of celldm Paolo Giannozzi
• 2012/08/22 [Pw_forum] QE 5.0 Release Confusion Paolo Giannozzi
• 2012/08/22 [Pw_forum] Bug in QE 5.0 with ibrav=0 and using a instead of celldm Giovanni Pizzi
• 2012/08/22 [Pw_forum] restart flag for nmr calculation using gipaw Prasenjit Ghosh
• 2012/08/22 [Pw_forum] Bug in QE 5.0 with ibrav=0 and using a instead of celldm Paolo Giannozzi
• 2012/08/22 [Pw_forum] path for automatic download of plugins Layla Martin-Samos
• 2012/08/22 [Pw_forum] Bug in QE 5.0 with ibrav=0 and using a instead of celldm Giovanni Pizzi
• 2012/08/22 [Pw_forum] '*****' in output files [email protected]
• 2012/08/22 [Pw_forum] [Q-e-developers] QE 5.0 Release Confusion Layla Martin-Samos
• 2012/08/22 [Pw_forum] QE 5.0 Release Confusion Filippo Spiga
• 2012/08/21 [Pw_forum] QE 5.0 Release Confusion DENIS MAGERO
• 2012/08/21 [Pw_forum] Dipole correction of PW Fenggong Wang
• 2012/08/21 [Pw_forum] question about spinors Alexey Akimov
• 2012/08/21 [Pw_forum] QE 5.0 Release Confusion W2AGZ
• 2012/08/21 [Pw_forum] confusion in ev.x karan deep
• 2012/08/21 [Pw_forum] GPU-accelerated PWscf Test Drive (provided by NVIDIA and partners) opens today Filippo Spiga
• 2012/08/20 [Pw_forum] GPU-accelerated PWscf Test Drive (provided by NVIDIA and partners) opens today Filippo Spiga
• 2012/08/20 [Pw_forum] About pseudopotential Axel Kohlmeyer
• 2012/08/20 [Pw_forum] About pseudopotential anne etindele
• 2012/08/20 [Pw_forum] MD restart algorithm in Quantum Espresso Paolo Giannozzi
• 2012/08/19 [Pw_forum] The files for lambda.x are missing! Peng Tao
• 2012/08/19 [Pw_forum] MD restart algorithm in Quantum Espresso Alexey Akimov
• 2012/08/18 [Pw_forum] MD restart algorithm in Quantum Espresso Axel Kohlmeyer
• 2012/08/18 [Pw_forum] MD restart algorithm in Quantum Espresso Alexey Akimov
• 2012/08/18 [Pw_forum] cp.x output: .pos Paolo Giannozzi
• 2012/08/18 [Pw_forum] cp.x output: .pos Paolo Giannozzi
• 2012/08/17 [Pw_forum] Input file for Cd6Se6 Darshana Wickramaratne
• 2012/08/17 [Pw_forum] Input file for Cd6Se6 Ruibin Liu
• 2012/08/17 [Pw_forum] MD restart algorithm in Quantum Espresso Paolo Giannozzi
• 2012/08/17 [Pw_forum] Input file for Cd6Se6 Paolo Giannozzi
• 2012/08/17 [Pw_forum] non-existed variables Paolo Giannozzi
• 2012/08/17 [Pw_forum] Input file for Cd6Se6 Ruibin Liu
• 2012/08/17 [Pw_forum] non-existed variables Ruibin Liu
• 2012/08/17 [Pw_forum] cp.x output: .pos Paolo Giannozzi
• 2012/08/17 [Pw_forum] cp.x output: .pos Paolo Giannozzi
• 2012/08/17 [Pw_forum] Difference in implementation in matdyn.x between versions 4.2.1 and 5.0.0? Paolo Giannozzi
• 2012/08/17 [Pw_forum] hibrid functionals Paolo Giannozzi
• 2012/08/17 [Pw_forum] plotrho.x refuses plotting charge ! Paolo Giannozzi
• 2012/08/17 [Pw_forum] k points weights Paolo Giannozzi
• 2012/08/16 [Pw_forum] non-existed variables Paolo Giannozzi
• 2012/08/15 [Pw_forum] (no subject) Satyananda Chab
• 2012/08/15 [Pw_forum] phonon calculations do not converge Iyad AL-QASIR
• 2012/08/15 [Pw_forum] phonon calculations do not converge Matthijs Mentink
• 2012/08/15 [Pw_forum] phonon calculations do not converge Iyad AL-QASIR
• 2012/08/15 [Pw_forum] Problem with parallel phonon calculation using image method David Miller
• 2012/08/14 [Pw_forum] Problem with parallel phonon calculation using image method William Parker
• 2012/08/14 [Pw_forum] 110-direction Vs 110-point calculation GAO Zhe
• 2012/08/14 [Pw_forum] 110-direction Vs 110-point calculation Satyananda Chab
• 2012/08/14 [Pw_forum] set_irr.f90 in v5.0 Andrea Dal Corso
• 2012/08/13 [Pw_forum] set_irr.f90 in v5.0 Jiseok Kim
• 2012/08/13 [Pw_forum] Problem with parallel phonon calculation using image method David Miller
• 2012/08/13 [Pw_forum] zns/zno surface Alexey Akimov
• 2012/08/13 [Pw_forum] zns/zno surface Amin Torabi
• 2012/08/13 [Pw_forum] Van der Walls interaction Stefano de Gironcoli
• 2012/08/13 [Pw_forum] QE plugins system Layla Martin-Samos
• 2012/08/13 [Pw_forum] QE plugins system Dmitry Korotin
• 2012/08/13 [Pw_forum] QE plugins system Layla Martin-Samos
• 2012/08/13 [Pw_forum] QE plugins system Dmitry Korotin
• 2012/08/12 [Pw_forum] phonon calculations do not converge Iyad AL-QASIR
• 2012/08/12 [Pw_forum] Van der Walls interaction Masoud
• 2012/08/12 [Pw_forum] Van der Walls interaction manoj narayanan
• 2012/08/12 [Pw_forum] Van der Walls interaction Masoud
• 2012/08/12 [Pw_forum] phonon calculation GAO Zhe
• 2012/08/12 [Pw_forum] phonon calculation Stefano Baroni
• 2012/08/12 [Pw_forum] piezoelectric constant Stefano Baroni
• 2012/08/11 [Pw_forum] Van der Walls interaction manoj narayanan
• 2012/08/11 [Pw_forum] phonon calculation Abolore Musari
• 2012/08/11 [Pw_forum] zns/zno surface Alexey Akimov
• 2012/08/10 [Pw_forum] piezoelectric constant GAO Zhe
• 2012/08/10 [Pw_forum] piezoelectric constant Alex Mariani
• 2012/08/10 [Pw_forum] phonon calculations do not converge William Parker
• 2012/08/10 [Pw_forum] phonon calculations do not converge Iyad AL-QASIR
• 2012/08/10 [Pw_forum] Fwd: problem of Tc calculation in electron phonon coefficents bhabya sahoo
• 2012/08/10 [Pw_forum] zns/zno surface Amin Torabi
• 2012/08/08 [Pw_forum] LSDA+U calculation on band gap Burak Himmetoglu
• 2012/08/08 [Pw_forum] LSDA+U calculation on band gap Peng Chen
• 2012/08/08 [Pw_forum] VDW-DF2 Stefano de Gironcoli
• 2012/08/08 [Pw_forum] VDW-DF2 bf azi
• 2012/08/08 [Pw_forum] LSDA+U calculation on band gap Burak Himmetoglu
• 2012/08/08 [Pw_forum] reading_namelist error #19 Masoud
• 2012/08/08 [Pw_forum] LSDA+U calculation on band gap Peng Chen
• 2012/08/08 [Pw_forum] reading_namelist error #19 Elie M
• 2012/08/08 [Pw_forum] reading_namelist error #19 Nicola Marzari
• 2012/08/08 [Pw_forum] reading_namelist error #19 Elie M
• 2012/08/08 [Pw_forum] QE plugins system Layla Martin-Samos
• 2012/08/08 [Pw_forum] QE plugins system Dmitry Korotin
• 2012/08/07 [Pw_forum] non-existed variables Ruibin Liu
• 2012/08/07 [Pw_forum] thanks Nyaruanda Calvince
• 2012/08/07 [Pw_forum] find out Guido Fratesi
• 2012/08/07 [Pw_forum] find out Nyaruanda Calvince
• 2012/08/07 [Pw_forum] Gamma point algorithm mahdi Davari
• 2012/08/06 [Pw_forum] Why my generated pp doesn't contain the information of number of Q-function(nqf)? Yue-Wen Fang
• 2012/08/06 [Pw_forum] Why my generated pp doesn't contain the information of number of Q-function(nqf)? Stefano Baroni
• 2012/08/06 [Pw_forum] Difference in implementation in matdyn.x between versions 4.2.1 and 5.0.0? Matthijs Mentink
• 2012/08/06 [Pw_forum] cp.x output: .pos xiaochuan Ge
• 2012/08/06 [Pw_forum] equilibrium lattice constant of magnetite Abolore Musari
• 2012/08/06 [Pw_forum] Quantum Espresso (4.3.2) and pure openmp runs (Axel Kohlmeyer) Cristian Degli Esposti Boschi
• 2012/08/06 [Pw_forum] Why my generated pp doesn't contain the information of number of Q-function(nqf)? Axel Kohlmeyer
• 2012/08/06 [Pw_forum] Why my generated pp doesn't contain the information of number of Q-function(nqf)? Yue-Wen Fang
• 2012/08/06 [Pw_forum] Why my generated pp doesn't contain the information of number of Q-function(nqf)? Axel Kohlmeyer
• 2012/08/06 [Pw_forum] Why my generated pp doesn't contain the information of number of Q-function(nqf)? Yue-Wen Fang
• 2012/08/06 [Pw_forum] installation Axel Kohlmeyer
• 2012/08/06 [Pw_forum] Why my generated pp doesn't contain the information of number of Q-function(nqf)? Axel Kohlmeyer
• 2012/08/06 [Pw_forum] equilibrium lattice constant of magnetite bamidele ibrahim
• 2012/08/06 [Pw_forum] equilibrium lattice constant of magnetite Jia Chen
• 2012/08/06 [Pw_forum] equilibrium lattice constant of magnetite Abolore Musari
• 2012/08/06 [Pw_forum] installation Abolore Musari
• 2012/08/06 [Pw_forum] equilibrium lattice constant of magnetite jia chen
• 2012/08/06 [Pw_forum] Why my generated pp doesn't contain the information of number of Q-function(nqf)? Yue-Wen Fang
• 2012/08/06 [Pw_forum] equilibrium lattice constant of magnetite Abolore Musari
• 2012/08/06 [Pw_forum] Why my generated pp doesn't contain the information of number of Q-function(nqf)? Yue-Wen Fang
• 2012/08/06 [Pw_forum] Quantum Espresso (4.3.2) and pure openmp runs Axel Kohlmeyer
• 2012/08/06 [Pw_forum] Quantum Espresso (4.3.2) and pure openmp runs Axel Kohlmeyer
• 2012/08/06 [Pw_forum] Quantum Espresso (4.3.2) and pure openmp runs Cristian Degli Esposti Boschi

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