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[Pw_forum] Different mesh for pseudopotential
Mahmoud Payami
[Pw_forum] Different mesh for pseudopotential
Paolo Giannozzi
[Pw_forum] Different mesh for pseudopotential
Paolo Giannozzi
[Pw_forum] Different mesh for pseudopotential
Mahmoud Payami
[Pw_forum] image parallelization for phonon calculations
IYAD AL-QASIR
[Pw_forum] image parallelization for phonon calculations
Paolo Giannozzi
[Pw_forum] image parallelization for phonon calculations
Lorenzo Paulatto
[Pw_forum] from 4.1 to 4.2 and 4.3.1 versions of QE in IBM sp6
giacsp...@libero.it
[Pw_forum] from 4.1 to 4.2 and 4.3.1 versions of QE in IBM sp6
Emine Kucukbenli
[Pw_forum] from 4.1 to 4.2 and 4.3.1 versions of QE in IBM sp6
Paolo Giannozzi
[Pw_forum] QHA frequency is higher than *.freq
KangYun Song
[Pw_forum] QHA frequency is higher than *.freq
KangYun Song
[Pw_forum] QHA frequency is higher than *.freq
KangYun Song
[Pw_forum] QHA frequency is higher than *.freq
KangYun Song
[Pw_forum] QHA frequency is higher than *.freq
Paolo Giannozzi
[Pw_forum] QHA frequency is higher than *.freq
KangYun Song
[Pw_forum] QHA frequency is higher than *.freq
Paolo Giannozzi
[Pw_forum] LDA scheme used in QE
Padmaja Patnaik
[Pw_forum] LDA scheme used in QE
Stefano de Gironcoli
[Pw_forum] Testing subscription
R.C.Pasianot
[Pw_forum] Testing subscription
Layla Martin-Samos
[Pw_forum] PAW potential for C
chengyu yang
[Pw_forum] PAW potential for C
Stefano de Gironcoli
[Pw_forum] PAW potential for C
chengyu yang
[Pw_forum] PAW potential for C
chengyu yang
[Pw_forum] PAW potential for C
Duy Le
[Pw_forum] PAW potential for C
chengyu yang
[Pw_forum] What is the total energy content of a compound?
r s
[Pw_forum] What is the total energy content of a compound?
Stefano Baroni
[Pw_forum] What is the total energy content of a compound?
Stefano Baroni
[Pw_forum] Query on "e-ph coupling"
Ajit Vallabhaneni
[Pw_forum] Query on "e-ph coupling"
Paolo Giannozzi
[Pw_forum] Query on "e-ph coupling"
Ajit Vallabhaneni
[Pw_forum] Query on "e-ph coupling"
Ajit Vallabhaneni
[Pw_forum] I need LDA pseudopotential of Mo
陶鹏
[Pw_forum] I need LDA pseudopotential of Mo
Paolo Giannozzi
[Pw_forum] I need LDA pseudopotential of Mo
陶鹏
[Pw_forum] Query on Xcrysden
Ajit Vallabhaneni
[Pw_forum] Query on Xcrysden
Ren PJ
[Pw_forum] Query on Xcrysden
Huiqun Zhou
[Pw_forum] general question on materials physics
pascal boulet
[Pw_forum] general question on materials physics
pascal boulet
[Pw_forum] general question on materials physics
pascal boulet
[Pw_forum] general question on materials physics
Stefano de Gironcoli
[Pw_forum] NEB Convergence Problem
Vic Bermudez
[Pw_forum] NEB Convergence Problem
Tone Kokalj
[Pw_forum] NEB Convergence Problem
Vic Bermudez
[Pw_forum] NEB Convergence Problem
Tone Kokalj
[Pw_forum] XCrysDen & Animation Capture
W2AGZ
[Pw_forum] XCrysDen & Animation Capture
Arles V. Gil Rebaza
[Pw_forum] XCrysDen & Animation Capture
Axel Kohlmeyer
[Pw_forum] XCrysDen & Animation Capture
Tone Kokalj
[Pw_forum] XCrysDen & Animation Capture
W2AGZ
[Pw_forum] How to show bands above fermi level in PDOS?
WF
[Pw_forum] How to show bands above fermi level in PDOS?
KangYun Song
[Pw_forum] How to show bands above fermi level in PDOS?
Paolo Giannozzi
[Pw_forum] Question about work function
Alexander G. Kvashnin
[Pw_forum] Defining spin states in PWscf
hariom jani
[Pw_forum] Defining spin states in PWscf
Andrea Dal Corso
[Pw_forum] mean square displacement amplitude for an atom
Payam Norouzzadeh
[Pw_forum] problem in scf run
Pankaj Pankaj
[Pw_forum] problem in scf run
Axel Kohlmeyer
[Pw_forum] problem in scf run
Stefano Baroni
[Pw_forum] problem in scf run
Axel Kohlmeyer
[Pw_forum] problem in scf run
Huiqun Zhou
[Pw_forum] k-path for phonon
Éric Germaneau
[Pw_forum] k-path for phonon
GAO Zhe
[Pw_forum] fortran compiler
F Anis
[Pw_forum] fortran compiler
Axel Kohlmeyer
[Pw_forum] fortran 90 for suse 11 linux
F Anis
[Pw_forum] fortran 90 for suse 11 linux
Lorenzo Paulatto
[Pw_forum] Phonon eigenvector calculation
Tribhuwan Pandey
[Pw_forum] Fwd: Phonon eigenvector calculation
Tribhuwan Pandey
[Pw_forum] V_loc |psi> in h_psi
Yun-Peng Wang
[Pw_forum] V_loc |psi> in h_psi
Lorenzo Paulatto
[Pw_forum] V_loc |psi> in h_psi
Stefano Baroni
[Pw_forum] Question regarding stars in postscript band plots
Éric Germaneau
[Pw_forum] Question regarding stars in postscript band plots
Paolo Giannozzi
[Pw_forum] electron-phonon calculations
Elie Moujaes
[Pw_forum] Pw_forum Digest, Vol 53, Issue 3
nicolas bruno
[Pw_forum] Pw_forum Digest, Vol 53, Issue 1
bahaareh tavakoli nejad
[Pw_forum] conflicting values icorr /igcx
Jörg Buchwald
[Pw_forum] conflicting values icorr /igcx
Paolo Giannozzi
[Pw_forum] conflicting values icorr /igcx
joerg.buchw...@iom-leipzig.de
[Pw_forum] conflicting values icorr /igcx
Paolo Giannozzi
[Pw_forum] conflicting values icorr /igcx
Jörg Buchwald
[Pw_forum] Berry phase electric field calculations with empty bands
Alexander Urban
[Pw_forum] Berry phase electric field calculations with empty bands
Paolo Giannozzi
[Pw_forum] Berry phase electric field calculations with empty bands
Alexander Urban
[Pw_forum] Berry phase electric field calculations with empty bands
Paolo Giannozzi
[Pw_forum] Structural properties
nicolas bruno
[Pw_forum] Structural properties
Arles V. Gil Rebaza
[Pw_forum] Structural properties
KangYun Song
[Pw_forum] Structural properties
Éric Germaneau
[Pw_forum] Please help me
陶鹏
[Pw_forum] Please help me
Axel Kohlmeyer
[Pw_forum] Please help me
陶鹏
[Pw_forum] Raman spectra calculation using QE
wumindt2
[Pw_forum] Raman spectra calculation using QE
bhabya sahoo
[Pw_forum] Raman spectra calculation using QE
Sanjeev Gupta
[Pw_forum] Raman spectra calculation using QE
Paolo Giannozzi
[Pw_forum] Raman spectra calculation using QE
bhabya sahoo
[Pw_forum] error in vc-relax
Abolore Musari
[Pw_forum] error in vc-relax
Lorenzo Paulatto
[Pw_forum] c_bands: X eigenvalues not converged
WF
[Pw_forum] QE interface to DP code
Michele Pisarra
[Pw_forum] QE interface to DP code
Stefano Baroni
[Pw_forum] QE interface to DP code
Layla Martin-Samos
[Pw_forum] QE interface to DP code
Layla Martin-Samos
[Pw_forum] structure oscillating with vc-md
Amin Torabi
[Pw_forum] structure oscillating with vc-md
Stefano de Gironcoli
[Pw_forum] structure oscillating with vc-md
Amin Torabi
[Pw_forum] Fermi energy from scf calculation
Tram Bui
[Pw_forum] Fermi energy from scf calculation
bamidele ibrahim
[Pw_forum] Fermi energy from scf calculation
Tram Bui
[Pw_forum] Fermi energy from scf calculation
Gabriele Sclauzero
[Pw_forum] Fermi energy from scf calculation
Tram Bui
[Pw_forum] Fermi energy from scf calculation
Paolo Giannozzi
[Pw_forum] Announcement - PhD IN PHYSICS University of Trieste - a.y. 2011/12
pere...@ts.infn.it
[Pw_forum] starting charge 209.99992, renormalised to 240.00000
Eduardo Ariel Menendez Proupin
[Pw_forum] starting charge 209.99992, renormalised to 240.00000
Paolo Giannozzi
[Pw_forum] A problem on GIPAW calculations
scj...@kbsi.re.kr
[Pw_forum] A problem on GIPAW calculations
Emine Kucukbenli
[Pw_forum] Raman spectra calculatio using QE
wumindt2
[Pw_forum] Raman spectra calculatio using QE
GAO Zhe
[Pw_forum] Raman spectra calculatio using QE
wumindt2
[Pw_forum] Raman spectra calculatio using QE
Paolo Giannozzi
[Pw_forum] USPP pseudopotentials for spin-orbit coupling calculations
Kiss, Ioan
[Pw_forum] USPP pseudopotentials for spin-orbit coupling calculations
Paolo Giannozzi
[Pw_forum] USPP pseudopotentials for spin-orbit coupling calculations
Andrea Dal Corso
[Pw_forum] Swapping
Payam Norouzzadeh
[Pw_forum] Swapping
Carlo Nervi
[Pw_forum] Swapping
Paolo Giannozzi
[Pw_forum] Swapping
Gabriele Sclauzero
[Pw_forum] Swapping
Payam Norouzzadeh
[Pw_forum] GIPAW: error in output
Carlo Nervi
[Pw_forum] GIPAW: error in output
Davide Ceresoli
[Pw_forum] GIPAW: error in output
Carlo Nervi
[Pw_forum] GIPAW: error in output
Lorenzo Paulatto
[Pw_forum] GIPAW: error in output
Carlo Nervi
[Pw_forum] GIPAW: error in output
Lorenzo Paulatto
[Pw_forum] GIPAW: error in output
Carlo Nervi
[Pw_forum] GIPAW: error in output
Paolo Giannozzi
[Pw_forum] GIPAW: error in output
Lorenzo Paulatto
[Pw_forum] GIPAW: error in output
KangYun Song
[Pw_forum] GIPAW: error in output
Davide Ceresoli
[Pw_forum] GIPAW: error in output
Carlo Nervi
[Pw_forum] Error in pseudopotential generation
Mahmoud Payami Shabestari
[Pw_forum] Error in pseudopotential generation
mohaddeseh abbasnejad
[Pw_forum] Error in pseudopotential generation
Mahmoud Payami Shabestari
[Pw_forum] correct values for "nns"
Mahmoud Payami Shabestari
[Pw_forum] correct values for "nns"
mohaddeseh abbasnejad
[Pw_forum] correct values for "nns"
Mahmoud Payami Shabestari
[Pw_forum] "nns"
Mahmoud Payami Shabestari
[Pw_forum] "nns"
Paolo Giannozzi
[Pw_forum] "nns"
Mahmoud Payami
[Pw_forum] Partial phonon DOS
jayashree....@jncasr.ac.in
[Pw_forum] Partial phonon DOS
GAO Zhe
[Pw_forum] Binding energy of Cu@CNT
chengyu yang
[Pw_forum] Binding energy of Cu@CNT
chengyu yang
[Pw_forum] Binding energy of Cu@CNT
chengyu yang
[Pw_forum] Binding energy of Cu@CNT
Paolo Giannozzi
[Pw_forum] Binding energy of Cu@CNT
chengyu yang
[Pw_forum] Binding energy of Cu@CNT
Stefano Baroni
[Pw_forum] Binding energy of Cu@CNT
chengyu yang
[Pw_forum] Binding energy of Cu@CNT
Stefano Baroni
[Pw_forum] Binding energy of Cu@CNT
Nguyen Doan Sau
[Pw_forum] Binding energy of Cu@CNT
chengyu yang
[Pw_forum] Binding energy of Cu@CNT
Stefano Baroni
[Pw_forum] convergence
bhabya sahoo
[Pw_forum] convergence
Stefano Baroni
[Pw_forum] convergence
Axel Kohlmeyer
[Pw_forum] convergence
bhabya sahoo
[Pw_forum] convergence
Emine Kucukbenli
[Pw_forum] convergence
bhabya sahoo
[Pw_forum] convergence
Emine Kucukbenli
[Pw_forum] convergence
bhabya sahoo
[Pw_forum] convergence
Tommaso Francese
[Pw_forum] convergence
Ijäs Mari
[Pw_forum] convergence
Arles V. Gil Rebaza
[Pw_forum] convergence
Paolo Giannozzi
[Pw_forum] themal conductivity
bhabya sahoo
[Pw_forum] WaveFunctions and eigenvectors
Michele Pisarra
[Pw_forum] WaveFunctions and eigenvectors
Paolo Giannozzi
[Pw_forum] Tr : Pw_forum Digest, Vol 52, Issue 61
debbichi mourad
[Pw_forum] Tr : Pw_forum Digest, Vol 52, Issue 61
mohnish pandey
[Pw_forum] Structure Optimization under Sawtooth potential
swapnil chandratre
[Pw_forum] Structure Optimization under Sawtooth potential
mohnish pandey
[Pw_forum] Running an input file
Gulcin Kucukdalyan
[Pw_forum] Running an input file
mohnish pandey
[Pw_forum] Running an input file
Gulcin Kucukdalyan
[Pw_forum] Running an input file
mohnish pandey
[Pw_forum] Running an input file
Emine Kucukbenli
[Pw_forum] Running an input file
Gulcin Kucukdalyan
[Pw_forum] Running an input file
Huiqun Zhou
[Pw_forum] MgH2 (input file)
Winfred Mulwa
[Pw_forum] MgH2 (input file)
Lorenzo Paulatto
[Pw_forum] BFGS ionic relax: maximum number of steps?
Xijun Wang
[Pw_forum] Example07
W2AGZ
[Pw_forum] Example07
Paolo Giannozzi
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