October 2009 Archives by thread

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Starting: Thu Oct 1 08:52:20 CEST 2009
Ending: Sat Oct 31 10:46:03 CET 2009
Messages: 374

• [Pw_forum] Projected DOS   Gabriele Sclauzero
• [Pw_forum] symmetry of defect state   Gabriele Sclauzero
• [Pw_forum] bug in mm_dispersion.f90   Daniel Forrer
  • [Pw_forum] bug in mm_dispersion.f90   Paolo Giannozzi
• [Pw_forum] epsilon.x uniaxial material   Silvia Bakalova
  • [Pw_forum] epsilon.x uniaxial material   Andrea Ferretti
  • [Pw_forum] how to build cell for diamagnetic material?   duchl06
    • [Pw_forum] how to build cell for diamagnetic material?   Duy Le
      • [Pw_forum] how to build cell for diamagnetic material?   Paolo Giannozzi
    • [Pw_forum] how to build cell for diamagnetic material?   xirainbow
      • [Pw_forum] how to build cell for diamagnetic material?   duchl06
      • [Pw_forum] how to build cell for diamagnetic material?   xirainbow
      • [Pw_forum] how to build cell for diamagnetic material?   Duy Le
      • [Pw_forum] how to build cell for diamagnetic material?   duchl06
      • [Pw_forum] how to build cell for diamagnetic material?   Gabriele Sclauzero
      • [Pw_forum] how to build cell for diamagnetic material?   duchl06
      • [Pw_forum] how to build cell for diamagnetic material?   Gabriele Sclauzero
      • [Pw_forum] how to build cell for diamagnetic material?   duchl06
• [Pw_forum] pwcond with spin-orbital effect   xirainbow
  • [Pw_forum] pwcond with spin-orbital effect   Gabriele Sclauzero
    • [Pw_forum] pwcond with spin-orbital effect   xirainbow
• [Pw_forum] defect   ali kazempour
  • [Pw_forum] defect   Gabriele Sclauzero
• [Pw_forum] Fw: defect   ali kazempour
  • [Pw_forum] Fw: defect   Gabriele Sclauzero
• [Pw_forum] Error building q-e 4.1 with Ubuntu 9.10 beta   Miguel Martínez
  • [Pw_forum] Error building q-e 4.1 with Ubuntu 9.10 beta   Paolo Giannozzi
  • [Pw_forum] Error building q-e 4.1 with Ubuntu 9.10 beta   James J Ramsey
    • [Pw_forum] Error building q-e 4.1 with Ubuntu 9.10 beta   Lorenzo Paulatto
      • [Pw_forum] Error building q-e 4.1 with Ubuntu 9.10 beta   James J Ramsey
      • [Pw_forum] Error building q-e 4.1 with Ubuntu 9.10 beta   Miguel Martínez
• [Pw_forum] (no subject)   shoutian sun
  • [Pw_forum] (no subject)   Stefano Baroni
  • [Pw_forum] (no subject)   kajal jindal
    • [Pw_forum] (no subject)   Nicola Marzari
    • [Pw_forum] (no subject)   Lorenzo Paulatto
    • [Pw_forum] (no subject)   Giuseppe Mattioli
• [Pw_forum] IR calculation   shoutian sun
• [Pw_forum] openmpi 1.3.3   Carlo Nervi
  • [Pw_forum] openmpi 1.3.3   Giovanni Cantele
    • [Pw_forum] openmpi 1.3.3   Carlo Nervi
      • [Pw_forum] openmpi 1.3.3   Paolo Giannozzi
  • [Pw_forum] openmpi 1.3.3   Paolo Giannozzi
• [Pw_forum] Band structure calculation   Bertrand SITAMTZE
  • [Pw_forum] Band structure calculation   Lorenzo Paulatto
  • [Pw_forum] Band structure calculation   Stefano Baroni
  • [Pw_forum] Band structure calculation   Bertrand SITAMTZE
    • [Pw_forum] Band structure calculation   shypirate
    • [Pw_forum] Band structure calculation   Stefano de Gironcoli
      • [Pw_forum] Band structure calculation   Bertrand SITAMTZE
      • [Pw_forum] How to generate a pp which is 3/4 of itself using virtual.x   Jun Dai
      • [Pw_forum] How to generate a pp which is 3/4 of itself using virtual.x   Stefano Baroni
      • [Pw_forum] How to generate a pp which is 3/4 of itself using virtual.x   Eyvaz Isaev
      • [Pw_forum] How to generate a pp which is 3/4 of itself using virtual.x   Jun Dai
      • [Pw_forum] How to generate a pp which is 3/4 of itself using virtual.x   Paolo Giannozzi
      • [Pw_forum] How to generate a pp which is 3/4 of itself using virtual.x   Stefano Baroni
      • [Pw_forum] How to generate a pp which is 3/4 of itself using virtual.x   Jun Dai
• [Pw_forum] IR   shoutian sun
  • [Pw_forum] IR   Stefano Baroni
  • [Pw_forum] IR   Somesh Kumar Bhattacharya
• [Pw_forum] Information on new release   vtmtrinh at caltech.edu
  • [Pw_forum] Information on new release   xirainbow
    • [Pw_forum] Information on new release   vtmtrinh at caltech.edu
  • [Pw_forum] Information on new release   Duy Le
    • [Pw_forum] Information on new release   vtmtrinh at caltech.edu
• [Pw_forum] scf calculation of isolated atom   udayagiri sai babu
  • [Pw_forum] scf calculation of isolated atom   Gabriele Sclauzero
  • [Pw_forum] scf calculation of isolated atom   Lorenzo Paulatto
    • [Pw_forum] scf calculation of isolated atom   udayagiri sai babu
• [Pw_forum] error in atomic coordinates   Marcello Rosini
  • [Pw_forum] error in atomic coordinates   Giovanni Cantele
    • [Pw_forum] error in atomic coordinates   Lorenzo Paulatto
• [Pw_forum] write on local disk   vtmtrinh at caltech.edu
  • [Pw_forum] write on local disk   Lorenzo Paulatto
    • [Pw_forum] write on local disk   vtmtrinh at caltech.edu
• [Pw_forum] Tips for vc-relax when far from equilibrium   Brad Malone
  • [Pw_forum] Tips for vc-relax when far from equilibrium   xirainbow
  • [Pw_forum] Tips for vc-relax when far from equilibrium   Paolo Giannozzi
• [Pw_forum] phonon errors   vtmtrinh at caltech.edu
  • [Pw_forum] phonon errors   Miguel Martínez
  • [Pw_forum] phonon errors   Paolo Giannozzi
    • [Pw_forum] phonon errors   vtmtrinh at caltech.edu
• [Pw_forum] PDOS on different Oxygen atoms   Huolin Xin
  • [Pw_forum] PDOS on different Oxygen atoms   Gabriele Sclauzero
• [Pw_forum] occupations fixed   udayagiri sai babu
  • [Pw_forum] occupations fixed   Lorenzo Paulatto
    • [Pw_forum] occupations fixed   udayagiri sai babu
      • [Pw_forum] occupations fixed   Lorenzo Paulatto
• [Pw_forum] phonon errors (vtmtrinh at caltech.edu)   Mikiyas Tsegaye
  • [Pw_forum] phonon errors (vtmtrinh at caltech.edu)   vtmtrinh at caltech.edu
    • [Pw_forum] phonon errors (vtmtrinh at caltech.edu)   Eyvaz Isaev
      • [Pw_forum] phonon errors (vtmtrinh at caltech.edu)   vtmtrinh at caltech.edu
• [Pw_forum] How to consider more valence electrons in Pseudopotentials?   Jiayu Dai
  • [Pw_forum] How to consider more valence electrons in Pseudopotentials?   Lorenzo Paulatto
  • [Pw_forum] How to consider more valence electrons inPseudopotentials?   Jiayu Dai
• [Pw_forum] again on OpenMPI 1.3.3   Carlo Nervi
• [Pw_forum] worth recompiling ?   Boris Skegin
  • [Pw_forum] worth recompiling ?   Carlo Nervi
• [Pw_forum] GIPAW pseudopotentials   Pallister, Peter
  • [Pw_forum] GIPAW pseudopotentials   Lorenzo Paulatto
    • [Pw_forum] GIPAW pseudopotentials   Pallister, Peter
      • [Pw_forum] GIPAW pseudopotentials   Ari P Seitsonen
      • [Pw_forum] GIPAW pseudopotentials   Pallister, Peter
      • [Pw_forum] GIPAW pseudopotentials   Lorenzo Paulatto
• [Pw_forum] Relaxation of low symmetry lattices   Manoj Srivastava
  • [Pw_forum] Relaxation of low symmetry lattices   Duy Le
  • [Pw_forum] Relaxation of low symmetry lattices   Stefano Baroni
    • [Pw_forum] Relaxation of low symmetry lattices   Dal Corso Andrea
  • [Pw_forum] Relaxation of low symmetry lattices   Gabriele Sclauzero
    • [Pw_forum] Relaxation of low symmetry lattices   Lorenzo Paulatto
      • [Pw_forum] Relaxation of low symmetry lattices   Manoj Srivastava
      • [Pw_forum] Relaxation of low symmetry lattices   Lorenzo Paulatto
      • [Pw_forum] Relaxation of low symmetry lattices   Stefano Baroni
      • [Pw_forum] Relaxation of low symmetry lattices   Gabriele Sclauzero
      • [Pw_forum] Relaxation of low symmetry lattices   Manoj Srivastava
• [Pw_forum] Use of Pseudo potential for functional blyp in the calculation with B3LYP functional   Luciano C.
  • [Pw_forum] Use of Pseudo potential for functional blyp in the calculation with B3LYP functional   William Parker
  • [Pw_forum] Use of Pseudo potential for functional blyp in the calculation with B3LYP functional   Duy Le
    • [Pw_forum] Use of Pseudo potential for functional blyp in the calculation with B3LYP functional   Paolo Giannozzi
• [Pw_forum] Relax calculation not converging   Dimpy Sharma
  • [Pw_forum] Relax calculation not converging   Mighfar Imam
    • [Pw_forum] Relax calculation not converging   Ary Junior
      • [Pw_forum] Relax calculation not converging   Huolin Xin
      • [Pw_forum] Relax calculation not converging   Duy Le
      • [Pw_forum] Relax calculation not converging   Paolo Giannozzi
  • [Pw_forum] Relax calculation not converging   Paolo Giannozzi
  • [Pw_forum] Relax calculation not converging   marsamos at democritos.it
• [Pw_forum] energy-degenerate states with different irrep labels   Silvia Bakalova
  • [Pw_forum] energy-degenerate states with different irrep labels   Gabriele Sclauzero
  • [Pw_forum] energy-degenerate states with different irrep labels   Silvia Bakalova
    • [Pw_forum] energy-degenerate states with different irrep labels   Gabriele Sclauzero
  • [Pw_forum] energy-degenerate states with different irrep labels   Silvia Bakalova
    • [Pw_forum] energy-degenerate states with different irrep labels   Gabriele Sclauzero
• [Pw_forum] use cvs   Chen, Zhifan
  • [Pw_forum] use cvs   Paolo Giannozzi
    • [Pw_forum] use cvs   Chen, Zhifan
      • [Pw_forum] use cvs   Paolo Giannozzi
• [Pw_forum] What is the meaning of dipfield=.true. ?   shypirate
  • [Pw_forum] What is the meaning of dipfield=.true. ?   Paolo Giannozzi
  • [Pw_forum] What is the meaning of dipfield=.true. ?   shypirate
• [Pw_forum] fhi2upf.x   dev sharma
  • [Pw_forum] fhi2upf.x   Lorenzo Paulatto
    • [Pw_forum] fhi2upf.x   dev sharma
• [Pw_forum] Electron Energy-Loss Near-Edge Fine Structure and Near Edge X-ray Absorption Fine Structure   Huolin Xin
• [Pw_forum] About the input file for matdyn.x   Reza Ebraahimi
  • [Pw_forum] About the input file for matdyn.x   Lorenzo Paulatto
• [Pw_forum] problem of scf calculation under electric field   shypirate
  • [Pw_forum] problem of scf calculation under electric field   Gabriele Sclauzero
• [Pw_forum] k points in epsilon.x   dev sharma
  • [Pw_forum] k points in epsilon.x   Gabriele Sclauzero
    • [Pw_forum] k points in epsilon.x   dev sharma
      • [Pw_forum] k points in epsilon.x   Gabriele Sclauzero
      • [Pw_forum] k points in epsilon.x   marsamos at democritos.it
      • [Pw_forum] k points in epsilon.x   dev sharma
      • [Pw_forum] k points in epsilon.x   Andrea Ferretti
      • [Pw_forum] k points in epsilon.x   dev sharma
      • [Pw_forum] k points in epsilon.x   Lorenzo Paulatto
      • [Pw_forum] k points in epsilon.x   Gabriele Sclauzero
      • [Pw_forum] k points in epsilon.x   Stefano Baroni
      • [Pw_forum] k points in epsilon.x   Gabriele Sclauzero
      • [Pw_forum] k points in epsilon.x   Stefano Baroni
• [Pw_forum] Reference for Fock Exchange Minimization Scheme?   William Parker
  • [Pw_forum] Reference for Fock Exchange Minimization Scheme?   Stefano Baroni
    • [Pw_forum] Reference for Fock Exchange Minimization Scheme?   William Parker
      • [Pw_forum] Reference for Fock Exchange Minimization Scheme?   Stefano de Gironcoli
      • [Pw_forum] Reference for Fock Exchange Minimization Scheme?   William Parker
• [Pw_forum] Wavefunction projections   Lex Kemper
  • [Pw_forum] Wavefunction projections   Stefano de Gironcoli
• [Pw_forum] 访问我的Netlog个人主页   黄宝陵
• [Pw_forum] Lowdin charge   Q.J.Wang
  • [Pw_forum] Lowdin charge   Paolo Giannozzi
    • [Pw_forum] Lowdin charge   Andrea Ferretti
• [Pw_forum] Pw_forum Digest, Vol 28, Issue 32   mtt physics
• [Pw_forum] Calculating projected density of states   Shaptrishi Sharma
  • [Pw_forum] Calculating projected density of states   Stefano Baroni
  • [Pw_forum] Calculating projected density of states   dev sharma
    • [Pw_forum] Calculating projected density of states   Lorenzo Paulatto
• [Pw_forum] forum searching   Mehrnaz Anvari
  • [Pw_forum] forum searching   James J Ramsey
  • [Pw_forum] forum searching   Tengfei Luo
• [Pw_forum] Questions on phonon calculation in Example02 and 06   vtmtrinh at caltech.edu
  • [Pw_forum] Questions on phonon calculation in Example02 and 06   Paolo Giannozzi
    • [Pw_forum] Questions on phonon calculation in Example02 and 06   vtmtrinh at caltech.edu
• [Pw_forum] total force ascend in the course of VC-relax   Q.J.Wang
  • [Pw_forum] total force ascend in the course of VC-relax   Lorenzo Paulatto
• [Pw_forum] Everything you always wanted to know about QE,   Nicola Marzari
  • [Pw_forum] Everything you always wanted to know about QE,   lan haiping
• [Pw_forum] how i can find tetragonal phase with PZT structure   mtt physics
  • [Pw_forum] how i can find tetragonal phase with PZT structure   Lorenzo Paulatto
    • [Pw_forum] how to use startingpot for different ecutwfc?   Ricardo Faccio
      • [Pw_forum] how to use startingpot for different ecutwfc?   Duy Le
      • [Pw_forum] how to use startingpot for different ecutwfc?   Lorenzo Paulatto
• [Pw_forum] Pw_forum Digest, Vol 28, Issue 38   Q.J.Wang
  • [Pw_forum] Pw_forum Digest, Vol 28, Issue 38   Lorenzo Paulatto
  • [Pw_forum] Pw_forum Digest, Vol 28, Issue 38   Paolo Giannozzi
• [Pw_forum] How to calculate the isotope effect   loc duong ding
  • [Pw_forum] How to calculate the isotope effect   lan haiping
  • [Pw_forum] How to calculate the isotope effect   Lorenzo Paulatto
    • [Pw_forum] How to calculate the isotope effect   Lorenzo Paulatto
  • [Pw_forum] How to calculate the isotope effect   Paolo Giannozzi
  • [Pw_forum] How to calculate the isotope effect   loc duong ding
  • [Pw_forum] How to calculate the isotope effect   Stefano Baroni
• [Pw_forum] partial phonon density of state   zq wu
  • [Pw_forum] partial phonon density of state   Gabriele Sclauzero
  • [Pw_forum] partial phonon density of state   Stefano Baroni
    • [Pw_forum] partial phonon density of state   zq wu
      • [Pw_forum] partial phonon density of state   Eyvaz Isaev
• [Pw_forum] Pw_forum Digest, Vol 28, Issue 40   Q.J.Wang
• [Pw_forum] MKL 10.2 not recognized by configure script / Xeon=amd64?   Matthias Timmer
  • [Pw_forum] MKL 10.2 not recognized by configure script / Xeon=amd64?   Paolo Giannozzi
    • [Pw_forum] MKL 10.2 not recognized by configure script / Xeon=amd64?   Carlo Nervi
      • [Pw_forum] MKL 10.2 not recognized by configure script / Xeon=amd64?   O. Baris Malcioglu
  • [Pw_forum] MKL 10.2 not recognized by configure script / Xeon=amd64?   James J Ramsey
  • [Pw_forum] MKL 10.2 not recognized by configure script / Xeon=amd64?   Goranka Bilalbegovic
  • [Pw_forum] MKL 10.2 not recognized by configure script / Xeon=amd64?   Matthias Timmer
    • [Pw_forum] MKL 10.2 not recognized by configure script / Xeon=amd64?   Lorenzo Paulatto
• [Pw_forum] Could Q-E benefit a lot from GPU computation.   vega lew
  • [Pw_forum] Could Q-E benefit a lot from GPU computation.   Paolo Giannozzi
    • [Pw_forum] Could Q-E benefit a lot from GPU computation.   Huolin Xin
    • [Pw_forum] Could Q-E benefit a lot from GPU computation.   vega lew
      • [Pw_forum] Could Q-E benefit a lot from GPU computation.   Stefano de Gironcoli
• [Pw_forum] Cr GGA potential is underestimating the cohesive energy.   udayagiri sai babu
  • [Pw_forum] Cr GGA potential is underestimating the cohesive energy.   Paolo Giannozzi
    • [Pw_forum] Cr GGA potential is underestimating the cohesive energy.   udayagiri sai babu
  • [Pw_forum] check on starting_magnetization   Guido Roma
    • [Pw_forum] check on starting_magnetization   Paolo Giannozzi
• [Pw_forum] c60   Chen, Zhifan
  • [Pw_forum] c60   lan haiping
    • [Pw_forum] c60   Gabriele Sclauzero
      • [Pw_forum] c60   Lorenzo Paulatto
      • [Pw_forum] c60   lan haiping
• [Pw_forum] lapack and BLAS   dev sharma
  • [Pw_forum] lapack and BLAS   lan haiping
  • [Pw_forum] lapack and BLAS   Lorenzo Paulatto
• [Pw_forum] yambo installation   dev sharma
  • [Pw_forum] yambo installation   iori at theory.polytechnique.fr
    • [Pw_forum] yambo installation   dev sharma
      • [Pw_forum] yambo installation   iori at theory.polytechnique.fr
      • [Pw_forum] yambo installation   Andrea Marini
• [Pw_forum] GWW-problem   ali kazempour
  • [Pw_forum] GWW-problem   Lorenzo Paulatto
    • [Pw_forum] GWW-problem   ali kazempour
• [Pw_forum] elctron-phonon   ali kazempour
  • [Pw_forum] elctron-phonon   lfhuang
  • [Pw_forum] elctron-phonon   lfhuang
• [Pw_forum] "cannot open xml_recover file for writing"   shu xu
  • [Pw_forum] "cannot open xml_recover file for writing"   Paolo Giannozzi
    • [Pw_forum] "cannot open xml_recover file for writing"   Ari P Seitsonen
      • [Pw_forum] "cannot open xml_recover file for writing"   Paolo Giannozzi
      • [Pw_forum] "cannot open xml_recover file for writing"   Lorenzo Paulatto
      • [Pw_forum] "cannot open xml_recover file for writing"   Prasenjit Ghosh
      • [Pw_forum] "cannot open xml_recover file for writing"   Lorenzo Paulatto
      • [Pw_forum] "cannot open xml_recover file for writing"   Ari P Seitsonen
      • [Pw_forum] "cannot open xml_recover file for writing"   marsamos at democritos.it
• [Pw_forum] I am sorry for sending two same mails in the previous volume!   lfhuang
• [Pw_forum] Problem on compiling pwscf   JAY
  • [Pw_forum] Problem on compiling pwscf   Paolo Giannozzi
  • [Pw_forum] Problem on compiling pwscf   marsamos at democritos.it
    • [Pw_forum] Problem on compiling pwscf   JAY
      • [Pw_forum] Problem on compiling pwscf   Lorenzo Paulatto
  • [Pw_forum] Problem on compiling pwscf   JAY
    • [Pw_forum] Problem on compiling pwscf   Paolo Giannozzi
• [Pw_forum] lelfield   Jiri Houska
  • [Pw_forum] lelfield   Lorenzo Paulatto
    • [Pw_forum] lelfield   Jiri Houska
      • [Pw_forum] lelfield   Paolo Giannozzi
      • [Pw_forum] lelfield   Jiri Houska
      • [Pw_forum] lelfield   Lorenzo Paulatto
• [Pw_forum] Left and right going Bloch's states from PWCOND   Manoj Srivastava
  • [Pw_forum] Left and right going Bloch's states from PWCOND   Alexander Smogunov
    • [Pw_forum] Left and right going Bloch's states from PWCOND   Manoj Srivastava
      • [Pw_forum] Left and right going Bloch's states from PWCOND   Alexander Smogunov
      • [Pw_forum] Left and right going Bloch's states from PWCOND   Manoj Srivastava
      • [Pw_forum] Left and right going Bloch's states from PWCOND   Alexander Smogunov
      • [Pw_forum] Left and right going Bloch's states from PWCOND   Manoj Srivastava
      • [Pw_forum] Left and right going Bloch's states from PWCOND   Manoj Srivastava
• [Pw_forum] GW calculations   dev sharma
  • [Pw_forum] GW calculations   Andrea Marini
    • [Pw_forum] GW calculations   dev sharma
      • [Pw_forum] GW calculations   Andrea Marini
• [Pw_forum] How dose the restart work?   Pieremanuele Canepa
  • [Pw_forum] How dose the restart work?   Lorenzo Paulatto
  • [Pw_forum] How dose the restart work?   Gabriele Sclauzero
    • [Pw_forum] How dose the restart work?   pc229 at kent.ac.uk
• [Pw_forum] Missing Wannier90 in Q-E 4.1.1?   Miguel Martínez
  • [Pw_forum] Missing Wannier90 in Q-E 4.1.1?   Paolo Giannozzi
    • [Pw_forum] Missing Wannier90 in Q-E 4.1.1?   Duy Le
• [Pw_forum] hard drive becomes read only during parallel QE 4.1.1 run with openmpi-1.3.3 intelv11 compilers   Derek Stewart
• [Pw_forum] problems calculating large numbers of empty states   Brad Malone
  • [Pw_forum] problems calculating large numbers of empty states   Paolo Giannozzi
    • [Pw_forum] problems calculating large numbers of empty states   Nicola Marzari
      • [Pw_forum] problems calculating large numbers of empty states   Paolo Giannozzi
  • [Pw_forum] electronic-phonon coupling error   Y.M.Qian
    • [Pw_forum] electronic-phonon coupling error   Paolo Giannozzi
      • [Pw_forum] electronic-phonon coupling error   Y.M.Qian
      • [Pw_forum] electronic-phonon coupling error   Paolo Giannozzi
      • [Pw_forum] electronic-phonon coupling error   Y.M.Qian
• [Pw_forum] Pw_forum Digest, Vol 28, Issue 58Re: Problem on compiling pwscf   JAY
  • [Pw_forum] Pw_forum Digest, Vol 28, Issue 58Re: Problem on compiling pwscf   James J Ramsey
• [Pw_forum] gap in the phonon DOS   Reza Ebraahimi
  • [Pw_forum] gap in the phonon DOS   xirainbow
  • [Pw_forum] gap in the phonon DOS   Eyvaz Isaev
    • [Pw_forum] gap in the phonon DOS   Reza Ebraahimi
      • [Pw_forum] gap in the phonon DOS   Stefano Baroni
      • [Pw_forum] gap in the phonon DOS   Nicola Marzari
      • [Pw_forum] gap in the phonon DOS   Eyvaz Isaev
• [Pw_forum] Espresso-4.1 failing to compile   Sangamesh B
  • [Pw_forum] Espresso-4.1 failing to compile   Paolo Giannozzi
• [Pw_forum] about elph calculations   Mehrnaz Anvari
• [Pw_forum] calculating equilibrium lattice constant   mohnish pandey
  • [Pw_forum] calculating equilibrium lattice constant   Nicola Marzari
  • [Pw_forum] calculating equilibrium lattice constant   Hande Ustunel
    • [Pw_forum] calculating equilibrium lattice constant   Lorenzo Paulatto
      • [Pw_forum] calculating equilibrium lattice constant   Hande Ustunel
    • [Pw_forum] calculating equilibrium lattice constant   mohnish pandey
  • [Pw_forum] calculating equilibrium lattice constant   Giovanni Cantele
• [Pw_forum] PPs of Aluminum using ld1 code(including 11 valence electrons)   Jiayu Dai
  • [Pw_forum] PPs of Aluminum using ld1 code(including 11 valence electrons)   Nicola Marzari
    • [Pw_forum] PPs of Aluminum using ld1 code(including 11 valence electrons)   Paolo Giannozzi
  • [Pw_forum] PPs of Aluminum using ld1 code(including 11 valenceelectrons)   Jiayu Dai
    • [Pw_forum] PPs of Aluminum using ld1 code(including 11 valenceelectrons)   Nicola Marzari
    • [Pw_forum] PPs of Aluminum using ld1 code(including 11 valenceelectrons)   Lorenzo Paulatto
  • [Pw_forum] PPs of Aluminum using ld1 code(including 11 valence electrons)   Paolo Giannozzi
• [Pw_forum] System size   Bertrand SITAMTZE
  • [Pw_forum] System size   Lorenzo Paulatto
    • [Pw_forum] System size   Bertrand SITAMTZE
• [Pw_forum] vc-relax bug?   Marcello Rosini
  • [Pw_forum] vc-relax bug?   Stefano de Gironcoli
• [Pw_forum] about potentials given by PP   Eduardo Ariel Menendez Proupin
  • [Pw_forum] about potentials given by PP   Lorenzo Paulatto
• [Pw_forum] convergence problems using GIPAW   Gregor Mali
  • [Pw_forum] convergence problems using GIPAW   Davide Ceresoli
    • [Pw_forum] convergence problems using GIPAW   Gregor Mali
• [Pw_forum] AFM not equal to 0   Q.J.Wang
  • [Pw_forum] AFM not equal to 0   Duy Le
• [Pw_forum] geometry optimization   mohnish pandey
  • [Pw_forum] geometry optimization   Lorenzo Paulatto
    • [Pw_forum] geometry optimization   mohnish pandey
• [Pw_forum] pair correlation function and the choice of fnosep   Bertrand SITAMTZE
  • [Pw_forum] pair correlation function and the choice of fnosep   Paolo Giannozzi
• [Pw_forum] pair correlation function and the choice of fnosep (fwd)   Antonio Tilocca
• [Pw_forum] Charge ordering with QE   Mulazzi Mattia
  • [Pw_forum] Charge ordering with QE   Nicola Marzari
  • [Pw_forum] Charge ordering with QE   Gabriele Sclauzero
• [Pw_forum] mixing_mode: "local-TF" and "TF".   Jiayu Dai
  • [Pw_forum] mixing_mode: "local-TF" and "TF".   Paolo Giannozzi
• [Pw_forum] about the nelec in the outputfile   lfhuang
  • [Pw_forum] about the nelec in the outputfile   Duy Le
  • [Pw_forum] about the nelec in the outputfile   lfhuang
    • [Pw_forum] nothing is written to the output file   Hong LI
      • [Pw_forum] nothing is written to the output file   Gabriele Sclauzero
• [Pw_forum] Looking for Manganse pseudopotential   Christian Santiago Helman
• [Pw_forum] About gaussian cubic format   saqib javaid
  • [Pw_forum] About gaussian cubic format   Paolo Giannozzi
  • [Pw_forum] About gaussian cubic format   saqib javaid
    • [Pw_forum] About gaussian cubic format   Paolo Giannozzi
    • [Pw_forum] About gaussian cubic format   Lorenzo Paulatto
      • [Pw_forum] About gaussian cubic format   Tone Kokalj
  • [Pw_forum] About gaussian cubic format   saqib javaid
    • [Pw_forum] About gaussian cubic format   Tone Kokalj
      • [Pw_forum] About gaussian cubic format   Paolo Giannozzi
      • [Pw_forum] About gaussian cubic format   Tone Kokalj
• [Pw_forum] plane averaged local potential   Eduardo Ariel Menendez Proupin
  • [Pw_forum] plane averaged local potential   Prasenjit Ghosh
    • [Pw_forum] plane averaged local potential   Gabriele Sclauzero
• [Pw_forum] About Debye Temp.   Reza Ebraahimi
• [Pw_forum] mpi-pwcond error   ambavale sagar
  • [Pw_forum] mpi-pwcond error   Lorenzo Paulatto
  • [Pw_forum] mpi-pwcond error   Gabriele Sclauzero
• [Pw_forum] el-ph for vacancy   ali kazempour
• [Pw_forum] Tetrahedra method   Arles V. Gil Rebaza
  • [Pw_forum] Tetrahedra method   Paolo Giannozzi
• [Pw_forum] which is the local potential   wujianchun
• [Pw_forum] umklapp part in elph calculations   Mehrnaz Anvari

Last message date: Sat Oct 31 10:46:03 CET 2009
Archived on: Wed Feb 28 11:04:05 CET 2018

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