October 2006 Archives by author
Starting: Sun Oct 1 03:22:26 CEST 2006
Ending: Tue Oct 31 23:27:43 CET 2006
Messages: 257
- [Pw_forum] about density
Amin Babazadeh
- [Pw_forum] about density
Amin Babazadeh
- [Pw_forum] about projwfc.x
Amin Babazadeh
- [Pw_forum] about generating pseudopotential
Amin Babazadeh
- [Pw_forum] about generating pseudopotential
Amin Babazadeh
- [Pw_forum] lattice vector defination
Stefano Baroni
- [Pw_forum] How to consider finite system 's deformation with PW method?
Stefano Baroni
- [Pw_forum] about density
Stefano Baroni
- [Pw_forum] born effective charges
Stefano Baroni
- [Pw_forum] relaxation of even-layer slab
Stefano Baroni
- [Pw_forum] nscf
Stefano Baroni
- [Pw_forum] ultrasoft pseudopotentials for Cs and I
Stefano Baroni
- [Pw_forum] electron phonon coupling of supercells
Stefano Baroni
- [Pw_forum] polarization calculation for system of surface states.
Stefano Baroni
- [Pw_forum] why total energy vs. lattice parameter is not a parabola?
Stefano Baroni
- [Pw_forum] why total energy vs. lattice parameter is not a parabola?
Stefano Baroni
- [Pw_forum] Sn USPP
Stefano Baroni
- [Pw_forum] question
Stefano Baroni
- [Pw_forum] URGENT
Stefano Baroni
- [Pw_forum] InfraRed intensities
Stefano Baroni
- [Pw_forum] InfraRed intensities
Stefano Baroni
- [Pw_forum] relaxation
Cyrille Barreteau
- [Pw_forum] Question about potential (pp tool)
Lilia Boeri
- [Pw_forum] Question about potential (pp tool)
Lilia Boeri
- [Pw_forum] Question about potential (pp tool)
Lilia Boeri
- [Pw_forum] Phonon calculation for UREA
Lilia Boeri
- [Pw_forum] Pseudopotential troubles
Miguel Martínez Canales
- [Pw_forum] Pseudopotential troubles
Miguel Martínez Canales
- [Pw_forum] More pseudopotential troubles
Miguel Martínez Canales
- [Pw_forum] nscf
Miguel Martínez Canales
- [Pw_forum] More pseudopotential troubles
Miguel Martínez Canales
- [Pw_forum] More pseudopotential troubles
Miguel Martínez Canales
- [Pw_forum] sufficient grid for phonon dispersion
Miguel Martínez Canales
- [Pw_forum] More pseudopotential troubles
Miguel Martínez Canales
- [Pw_forum] Non cubic structures
Miguel Martínez Canales
- [Pw_forum] help on generating pseudopotential
Miguel Martínez Canales
- [Pw_forum] NMR properties
Davide Ceresoli
- [Pw_forum] question
Andrea Dal Corso
- [Pw_forum] phonon calculation
Xunlei Ding
- [Pw_forum] Help: the error of computaion single atom
Xunlei Ding
- [Pw_forum] Linking of pw.x reported wrong ElF class
Andrea Ferretti
- [Pw_forum] Compiling espresso-3.1.1 on AMD Athlon 4200/Linux-64
Andrea Ferretti
- [Pw_forum] matdyn.x: write out complete dynamical matrices
Katalin Gaal-Nagy
- [Pw_forum] lattice vector defination
Paolo Giannozzi
- [Pw_forum] lattice vector defination
Paolo Giannozzi
- [Pw_forum] pwscf 3.* good for production?
Paolo Giannozzi
- [Pw_forum] pwscf 3.* good for production?
Paolo Giannozzi
- [Pw_forum] Configure and Compile problems on Solaris 10
Paolo Giannozzi
- [Pw_forum] Compilation on SGI Origin 300
Paolo Giannozzi
- [Pw_forum] Compilation on SGI Origin 300
Paolo Giannozzi
- [Pw_forum] Compilation on SGI Origin 300
Paolo Giannozzi
- [Pw_forum] Compilation on SGI Origin 300
Paolo Giannozzi
- [Pw_forum] Compilation on SGI
Paolo Giannozzi
- [Pw_forum] Question about potential (pp tool)
Paolo Giannozzi
- [Pw_forum] Linking of pw.x reported wrong ElF class
Paolo Giannozzi
- [Pw_forum] Solaris 10 make failure in cplib.o
Paolo Giannozzi
- [Pw_forum] Solaris 10 pw.x complies but will not run
Paolo Giannozzi
- [Pw_forum] Compatibility among different versions
Paolo Giannozzi
- [Pw_forum] Pseudopotential troubles
Paolo Giannozzi
- [Pw_forum] Problem of the underestimation of the frequency caused by matdyn.x
Paolo Giannozzi
- [Pw_forum] born effective charges
Paolo Giannozzi
- [Pw_forum] about projwfc.x
Paolo Giannozzi
- [Pw_forum] phonon at a specifiec point
Paolo Giannozzi
- [Pw_forum] born effective charges
Paolo Giannozzi
- [Pw_forum] born effective charges
Paolo Giannozzi
- [Pw_forum] nscf
Paolo Giannozzi
- [Pw_forum] about generating pseudopotential
Paolo Giannozzi
- [Pw_forum] nscf
Paolo Giannozzi
- [Pw_forum] problem with pseudopotential
Paolo Giannozzi
- [Pw_forum] electron phonon coupling of supercells
Paolo Giannozzi
- [Pw_forum] pseudopotential problems
Paolo Giannozzi
- [Pw_forum] Help: the error of computaion single atom
Paolo Giannozzi
- [Pw_forum] phonon calculation
Paolo Giannozzi
- [Pw_forum] More pseudopotential troubles
Paolo Giannozzi
- [Pw_forum] Re: Pw_forum digest, Vol 1 #1182 - 7 msgs
Paolo Giannozzi
- [Pw_forum] unsubscribe me
Paolo Giannozzi
- [Pw_forum] More pseudopotential troubles
Paolo Giannozzi
- [Pw_forum] sufficient grid for phonon dispersion
Paolo Giannozzi
- [Pw_forum] Error diis diagonalization?
Paolo Giannozzi
- [Pw_forum] RE: about projwfc.x
Paolo Giannozzi
- [Pw_forum] unsubscribe me
Paolo Giannozzi
- [Pw_forum] Compiling espresso-3.1.1 on AMD Athlon 4200/Linux-64
Paolo Giannozzi
- [Pw_forum] questions about symmetry and the elphon output
Paolo Giannozzi
- [Pw_forum] Error on calculation GS cp.x?
Paolo Giannozzi
- [Pw_forum] question about bands calculation
Paolo Giannozzi
- [Pw_forum] Compiling espresso-3.1.1 on AMD Athlon 4200/Linux-64
Paolo Giannozzi
- [Pw_forum] error in para_zcholdc
Paolo Giannozzi
- [Pw_forum] help: phonon calculation of Ag
Paolo Giannozzi
- [Pw_forum] problems in the el-ph/phonon calculations
Paolo Giannozzi
- [Pw_forum] cube file from pp.x with orthogonal unit cell
Paolo Giannozzi
- [Pw_forum] problems with integrated charge
Paolo Giannozzi
- [Pw_forum] Re: from Srijan
Paolo Giannozzi
- [Pw_forum] problems with integrated charge
Paolo Giannozzi
- [Pw_forum] Re: from Srijan
Paolo Giannozzi
- [Pw_forum] Re: Pw_forum digest, Vol 1 #1208 - 1 msg
Paolo Giannozzi
- [Pw_forum] timer on XT3
Paolo Giannozzi
- [Pw_forum] Problems with yahoo accounts
Paolo Giannozzi
- [Pw_forum] about disordered structures
Stefano de Gironcoli
- [Pw_forum] Pseudopotential with semicore states
Stefano de Gironcoli
- [Pw_forum] relaxation of even-layer slab
Stefano de Gironcoli
- [Pw_forum] In pseudopotential with 4d electrons as valance
Stefano de Gironcoli
- [Pw_forum] nscf
H.S.Domingos
- [Pw_forum] nscf
H.S.Domingos
- [Pw_forum] nscf
H.S.Domingos
- [Pw_forum] why total energy vs. lattice parameter is not a parabola?
H.S.Domingos
- [Pw_forum] Error diis diagonalization?
Nguyen Ngoc Ha
- [Pw_forum] Error on calculation GS cp.x?
Nguyen Ngoc Ha
- [Pw_forum] band structure
Eyvaz Isaev
- [Pw_forum] nscf
Eyvaz Isaev
- [Pw_forum] Help: the error of computaion single atom
Eyvaz Isaev
- [Pw_forum] electron phonon coupling of supercells
Eyvaz Isaev
- [Pw_forum] electron phonon coupling of supercells
Eyvaz Isaev
- [Pw_forum] Masses in .dyn file
Eyvaz Isaev
- [Pw_forum] InfraRed intensities
Manish Jain
- [Pw_forum] InfraRed intensities
Manish Jain
- [Pw_forum] Compilation on SGI
Axel Kohlmeyer
- [Pw_forum] URGENT
Axel Kohlmeyer
- [Pw_forum] Re: Pw_forum digest, Vol 1 #1208 - 1 msg
Axel Kohlmeyer
- [Pw_forum] constraint variable cell relaxation
Jess Kondor
- [Pw_forum] constraint variable cell relaxation
Jess Kondor
- [Pw_forum] Raman spectra for (almost) metallic systems
Konstantin Kudin
- [Pw_forum] URGENT
Amit Kumar
- [Pw_forum] Re: Pw_forum digest, Vol 1 #1208 - 1 msg
Amit Kumar
- [Pw_forum] Compatibility among different versions
Tianshu Li
- [Pw_forum] Re: Pw_forum digest, Vol 1 #1173 - 1 msg
Tianshu Li
- [Pw_forum] error in para_zcholdc
Sergey Lisenkov
- [Pw_forum] timer on XT3
Sergey Lisenkov
- [Pw_forum] How to consider finite system 's deformation with PW method?
Nicola Marzari
- [Pw_forum] electron phonon coupling of supercells
Nicola Marzari
- Fwd: [Pw_forum] CP breakdown for long simulations?
Nicola Marzari
- [Pw_forum] URGENT
Nicola Marzari
- [Pw_forum] Non cubic structures
Nicola Marzari
- [Pw_forum] Non cubic structures
Nicola Marzari
- [Pw_forum] Announcement - Trieste Total Energy Workshop, 11-13 January 2007
Nicola Marzari
- [Pw_forum] unsubscribe me
Ashish Mhadeshwar
- [Pw_forum] Compilation on SGI Origin 300
Miao, Maosheng
- [Pw_forum] Compilation on SGI Origin 300
Miao, Maosheng
- [Pw_forum] Compilation on SGI Origin 300
Miao, Maosheng
- [Pw_forum] Compilation on SGI Origin 300
Miao, Maosheng
- [Pw_forum] Compilation on SGI Origin 300
Miao, Maosheng
- [Pw_forum] Compilation on SGI Origin 300
Miao, Maosheng
- [Pw_forum] Compilation on SGI
Miao, Maosheng
- [Pw_forum] Compilation on SGI
Miao, Maosheng
- [Pw_forum] Phonon calculation for UREA
Miao, Maosheng
- [Pw_forum] Phonon calculation for UREA
Miao, Maosheng
- [Pw_forum] about projwfc.x
Ruslan Minibaev
- [Pw_forum] Re: about projwfc
Ruslan Minibaev
- [Pw_forum] Re: Pw_forum digest, Vol 1 #1182 - 7 msgs
Ruslan Minibaev
- [Pw_forum] RE: about projwfc.x
Ruslan Minibaev
- [Pw_forum] Sn USPP
Ruslan Minibaev
- [Pw_forum] cube file from pp.x with orthogonal unit cell
Garold Murdachaew
- [Pw_forum] unoccupied states
Gana Natarajan
- [Pw_forum] Bug in PH/clinear.f90
Yingli Niu
- [Pw_forum] Bug in PH/clinear.f90
Yingli Niu
- [Pw_forum] born effective charges
Vivek Ranjan
- [Fwd: Re: [Pw_forum] born effective charges]
Vivek Ranjan
- [Pw_forum] bfgs and trust radius
Vivek Ranjan
- [Pw_forum] problems with integrated charge
Vivek Ranjan
- [Pw_forum] problems with integrated charge
Vivek Ranjan
- [Pw_forum] fluorine psp
Vivek Ranjan
- [Pw_forum] help on generating pseudopotential
Vivek Ranjan
- [Pw_forum] NMR properties
K.Hari Krishna Reddy
- [Pw_forum] Re: from Srijan
Srijan Kumar Saha
- [Pw_forum] Re: from Srijan
Srijan Kumar Saha
- [Pw_forum] Re: from Srijan
Srijan Kumar Saha
- [Pw_forum] Re: from Srijan
Srijan Kumar Saha
- [Pw_forum] Non cubic structures
Srijan Kumar Saha
- [Pw_forum] Non cubic structures
Srijan Kumar Saha
- [Pw_forum] bfgs and trust radius
Carlo Sbraccia
- [Pw_forum] phonon at a specifiec point
Ezad Shojaee
- [Pw_forum] phonon calculation
Ezad Shojaee
- [Pw_forum] sufficient grid for phonon dispersion
Ezad Shojaee
- [Pw_forum] sufficient grid for phonon dispersion
Ezad Shojaee
- [Pw_forum] phonon calculation
Ezad Shojaee
- [Pw_forum] pwscf 3.* good for production?
Antonio Suriano
- [Pw_forum] pwscf 3.* good for production?
Antonio Suriano
- [Pw_forum] Configure and Compile problems on Solaris 10
Stan Toporek
- [Pw_forum] Linking of pw.x reported wrong ElF class
Stan Toporek
- [Pw_forum] Re: Problem linking pw.x on solaris 10
Stan Toporek
- [Pw_forum] Solaris 10 make failure in cplib.o
Stan Toporek
- [Pw_forum] SunStudio 11 for free
Stan Toporek
- [Pw_forum] Solaris 10 pw.x complies but will not run
Stan Toporek
- [Pw_forum] a question about electron-phonon coupling
Malgorzata Wierzbowska
- [Pw_forum] Bug in PH/clinear.f90
Malgorzata Wierzbowska
- [Pw_forum] Question about potential (pp tool)
Malgorzata Wierzbowska
- [Pw_forum] Problem of the underestimation of the frequency caused by matdyn.x
Malgorzata Wierzbowska
- [Pw_forum] Re: **Suspected SPAM** [Pw_forum] Re: Re: [Pw_forum] Problem of the underestimation of the frequency caused by matdyn.x
Malgorzata Wierzbowska
- [Pw_forum] error in the el-ph calculation
Malgorzata Wierzbowska
- [Pw_forum] about generating pseudopotential
Malgorzata Wierzbowska
- [Pw_forum] problems with integrated charge
Malgorzata Wierzbowska
- [Pw_forum] CP breakdown for long simulations?
Brandon Wood
- [Pw_forum] problems with integrated charge
Liping YU
- [Pw_forum] error in the el-ph calculation
Jia-An Yan
- [Pw_forum] questions about symmetry and the elphon output
Jia-An Yan
- [Pw_forum] questions about symmetry and the elphon output
Jia-An Yan
- [Pw_forum] problems in the el-ph/phonon calculations
Jia-An Yan
- [Pw_forum] Masses in .dyn file
Marino Vetuschi Zuccolini
- [Pw_forum] Masses in .dyn file
Marino Vetuschi Zuccolini
- [Pw_forum] band structure
rudra banerjee
- [Pw_forum] unsubscribe me
rudra banerjee
- [Pw_forum] unsubscribe me
rudra banerjee
- [Pw_forum] CHAN Serene is out of the office.
serenechan at charteredsemi.com
- [Pw_forum] 2nd Annual CNF Fall Workshop "Building Nanostructures Bit by Bit"
stewart at cnf.cornell.edu
- [Pw_forum] Question about potential (pp tool)
degironc
- [Pw_forum] Question about potential (pp tool)
degironc
- [Pw_forum] How to consider finite system 's deformation with PW method?
lan haiping
- [Pw_forum] How to consider finite system 's deformation with PW method?
lan haiping
- [Pw_forum] polarization calculation for system of surface states.
lan haiping
- [Pw_forum] sufficient grid for phonon dispersion
lan haiping
- [Pw_forum] Error diis diagonalization?
lan haiping
- [Pw_forum] polarization calculation for system of surface states.
lan haiping
- [Pw_forum] question about bands calculation
lan haiping
- [Pw_forum] question about bands calculation
lan haiping
- [Pw_forum] question about bands calculation
lan haiping
- [Pw_forum] question about bands calculation
lan haiping
- [Pw_forum] question about bands calculation
lan haiping
- [Pw_forum] Re: Pw_forum digest, Vol 1 #1208 - 1 msg
lan haiping
- [Pw_forum] unoccupied states
lan haiping
- [Pw_forum] about disordered structures
sun jian
- [Pw_forum] Compiling espresso-3.1.1 on AMD Athlon 4200/Linux-64
gryko at jsu.edu
- [Pw_forum] Compiling espresso-3.1.1 on AMD Athlon 4200/Linux-64
gryko at jsu.edu
- [Pw_forum] Summary: Compiling espresso-3.1.1 on AMD Athlon 4200/Linux-64
gryko at jsu.edu
- [Pw_forum] Pseudopotential with semicore states
e kb
- [Pw_forum] Pseudopotential with semicore states
e kb
- [Pw_forum] In pseudopotential with 4d electrons as valance
e kb
- [Pw_forum] LATTICE VECTOR DEFINATION
luch001
- [Pw_forum] LATTICE VECTOR DEFINATION
luch001
- [Pw_forum] lattice vector defination
luch001
- [Pw_forum] problem with pseudopotential
luch001
- [Pw_forum] problem with pseudopotential
luch001
- [Pw_forum] electron-phonon coupling calculation on s upercell
luch001
- [Pw_forum] electron phonon coupling of supercells
luch001
- [Pw_forum] pseudopotential problems
luch001
- [Pw_forum] electron phonon coupling of supercells
luch001
- [Pw_forum] relaxation of even-layer slab
lucky8121
- [Pw_forum] relaxation of even-layer slab
lucky8121
- [Pw_forum] relaxation of even-layer slab
lucky8121
- [Pw_forum] constraint variable cell relaxation
cesards at msi.umn.edu
- [Pw_forum] question about bands calculation
lukethulin at netscape.net
- [Pw_forum] question about bands calculation
lukethulin at netscape.net
- [Pw_forum] question about bands calculation
lukethulin at netscape.net
- [Pw_forum] question about bands calculation
lukethulin at netscape.net
- [Pw_forum] why total energy vs. lattice parameter is not a parabola?
vu ongphuong
- [Pw_forum] Help: the error of computaion single atom
shangyi
- [Pw_forum] Re: Help: the error of computaion single atom
shangyi
- [Pw_forum] problem about calculate the phonon frequencies
zhou xiangfeng
- [Pw_forum] Problem of the underestimation of the frequency caused by matdyn.x
li yan
- [Pw_forum] Re: Re: [Pw_forum] Problem of the underestimation of the frequency caused by matdyn.x
li yan
- [Pw_forum] ultrasoft pseudopotentials for Cs and I
li yan
- [Pw_forum] wang yanchao wants to chat
wang yanchao
- [Pw_forum] question
wang yanchao
- [Pw_forum] Re: Pw_forum digest, Vol 1 #1203 - 3 msgs
wang yanchao
- [Pw_forum] Re: Pw_forum digest, Vol 1 #1203 - 3 msgs
wang yanchao
- [Pw_forum] Re: [Pw_forum] Re: Re: [Pw_forum] Problem of the underestimation of the frequency caused by matdyn.x
yanmingma
- [Pw_forum] help: phonon calculation of Ag
hailin yu
- [Pw_forum] help: phonon calculation of Ag
hailin yu
- [Pw_forum] help: phonon calculation of Ag
hailin yu
Last message date:
Tue Oct 31 23:27:43 CET 2006
Archived on: Tue Jul 10 14:24:12 CEST 2007
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