March 2008 Archives by date
Starting: Sat Mar 1 01:00:05 CET 2008
Ending: Mon Mar 31 22:58:45 CEST 2008
Messages: 211
- [Pw_forum] Zn pp problem using ld1.x
Andres Botello
- [Pw_forum] davcio: error # 10 when running projwfc.x
Yaser Rehem
- [Pw_forum] davcio: error # 10 when running projwfc.x
Axel Kohlmeyer
- [Pw_forum] davcio: error # 10 when running projwfc.x
Paolo Giannozzi
- [Pw_forum] complex band calculation
ambavale sagar
- [Pw_forum] complex band calculation
Alexander
- [Pw_forum] stack.c in Mac OS X/Intel
Cesar R.S. da Silva
- [Pw_forum] stack.c in Mac OS X/Intel
Paolo Giannozzi
- [Pw_forum] undefined reference to mkl_serv_load_dll'/load_fun'
Osman Barış Malcıoğlu
- [Pw_forum] undefined reference to mkl_serv_load_dll'/load_fun'
lan haiping
- [Pw_forum] undefined reference to mkl_serv_load_dll'/load_fun'
Paolo Giannozzi
- [Pw_forum] undefined reference to mkl_serv_load_dll'/load_fun'
Paolo Giannozzi
- [Pw_forum] undefined reference to mkl_serv_load_dll'/load_fun'
nazari at iasbs.ac.ir
- [Pw_forum] undefined reference to mkl_serv_load_dll'/load_fun'
nazari at iasbs.ac.ir
- [Pw_forum] stack.c in Mac OS X/Intel
Axel Kohlmeyer
- [Pw_forum] how to cite pwscf
Nicola Marzari
- [Pw_forum] [Pw_users] Pre-release of Quantum-Espresso v.4
Axel Kohlmeyer
- [Pw_forum] [Pw_users] Pre-release of Quantum-Espresso v.4
Giovanni Cantele
- [Pw_forum] [Pw_users] Pre-release of Quantum-Espresso v.4
Giovanni Cantele
- [Pw_forum] [Pw_users] Pre-release of Quantum-Espresso v.4
Paolo Giannozzi
- [Pw_forum] [Pw_users] Pre-release of Quantum-Espresso v.4
Axel Kohlmeyer
- [Pw_forum] [Pw_users] Pre-release of Quantum-Espresso v.4
Giovanni Cantele
- [Pw_forum] complex band calculation
ambavale sagar
- [Pw_forum] postdoctoral positions and internships in first-principles computational materials science, MIT
Nicola Marzari
- [Pw_forum] complex band calculation
Paolo Giannozzi
- [Pw_forum] How to get ionization potential
Jianguo Wang (jianguow at Princeton.EDU)
- [Pw_forum] bfgs vc-relaxation in 4.0cvs
Jess Kondor
- [Pw_forum] ultrasoft pseudopotential
Y.L. Xie
- [Pw_forum] ultrasoft pseudopotential
Axel Kohlmeyer
- [Pw_forum] ultrasoft pseudopotential
Stefano Baroni
- [Pw_forum] bfgs vc-relaxation in 4.0cvs
j.antonio.montoya at gmail.com
- [Pw_forum] questions about some parameter in cp.x
hyello25 Qgrui
- [Pw_forum] questions on the acoustic sum rule crystal
Eduardo Ariel Menendez Proupin
- [Pw_forum] questions on the acoustic sum rule crystal
Nicola Marzari
- [Pw_forum] calculation with 'CONSTRAINTS' cards
shruba at gmail.com
- [Pw_forum] Significant figures of band energies
EG Kim
- [Pw_forum] questions on the acoustic sum rule crystal
stewart at cnf.cornell.edu
- [Pw_forum] Significant figures of band energies
Paolo Giannozzi
- [Pw_forum] How to get ionization potential
Paolo Giannozzi
- [Pw_forum] calculation with 'CONSTRAINTS' cards
Paolo Giannozzi
- [Pw_forum] k point selection.
Li yan-ling
- [Pw_forum] questions about some parameter in cp.x
Paolo Giannozzi
- [Pw_forum] H pseudopotential
Marci
- [Pw_forum] Pw_forum Digest, Vol 9, Issue 11
EG Kim
- [Pw_forum] Problem to calculate Charge density measurement of Tantalum diboride(TaB2)
Nusrat Jahan
- [Pw_forum] seeking transition metal oxide atomic positions and cell vectors
Yaser Rehem
- [Pw_forum] dangling bond
ali kazempoor
- [Pw_forum] charged species
Igor Pasti
- [Pw_forum] charged species
Nicola Marzari
- [Pw_forum] dangling bond
Paolo Giannozzi
- [Pw_forum] chdens.x
Álvaro Alves
- [Pw_forum] chdens.x
Giovanni Cantele
- [Pw_forum] linking fftw?
ambavale sagar
- [Pw_forum] linking fftw?
Paolo Giannozzi
- [Pw_forum] How to compile pwscf on hp-ux ia64
Jun Dai
- [Pw_forum] How to compile pwscf on hp-ux ia64
Paolo Giannozzi
- [Pw_forum] How to compile pwscf on hp-ux ia64
Jun Dai
- [Pw_forum] How to compile pwscf on hp-ux ia64
Axel Kohlmeyer
- [Pw_forum] charged species (Nicola Marzari)
Igor Pasti
- [Pw_forum] Pentium-M versus Itanium
Miguel Martínez Canales
- [Pw_forum] Pentium-M versus Itanium
Axel Kohlmeyer
- [Pw_forum] Pw_forum Digest, Vol 9, Issue 14
Viet Bac
- [Pw_forum] Combining WFC files?
Min Seung Kyu
- [Pw_forum] Combining WFC files?
Zhu Xi
- [Pw_forum] Pentium-M versus Itanium
Aleksandr Shaposhnikov
- [Pw_forum] Mass of the atomic for relax
Viet Bac
- [Pw_forum] Combining WFC files?
Paolo Giannozzi
- [Pw_forum] Pentium-M versus Itanium
Paolo Giannozzi
- [Pw_forum] Combining WFC files?
Andrea Ferretti
- [Pw_forum] Pentium-M versus Itanium
Miguel Martínez Canales
- [Pw_forum] Pentium-M versus Itanium
Paolo Giannozzi
- [Pw_forum] Benchmarks (was Pentium-M versus Itanium)
Nicola Marzari
- [Pw_forum] Benchmarks (was Pentium-M versus Itanium)
Aleksandr Shaposhnikov
- [Pw_forum] Benchmarks (was Pentium-M versus Itanium)
Paolo Giannozzi
- [Pw_forum] Benchmarks (was Pentium-M versus Itanium)
Nicola Marzari
- [Pw_forum] Benchmarks (was Pentium-M versus Itanium)
Axel Kohlmeyer
- [Pw_forum] Running espresso-3.2.3 examples
Amos Leffler
- [Pw_forum] Running espresso-3.2.3 examples
Axel Kohlmeyer
- [Pw_forum] bfgs vc-relaxation in 4.0cvs
Jess Kondor
- [Pw_forum] I want to
r95222066 at ntu.edu.tw
- [Pw_forum] I want to ask how to construct anti-ferromagnetic structure ?
r95222066 at ntu.edu.tw
- [Pw_forum] I wnat to ask why the DOS calculation of conduction part disappeared ?
r95222066 at ntu.edu.tw
- [Pw_forum] I wnat to ask how to use the code" projectwfc.x" output to calculation magnetic moment ?
r95222066 at ntu.edu.tw
- [Pw_forum] I want to ask how to construct anti-ferromagnetic structure ?
Axel Kohlmeyer
- [Pw_forum] I wnat to ask why the DOS calculation of conduction part disappeared ?
Axel Kohlmeyer
- [Pw_forum] I wnat to ask how to use the code" projectwfc.x" output to calculation magnetic moment ?
Paolo Giannozzi
- [Pw_forum] Mass of the atomic for relax
Paolo Giannozzi
- [Pw_forum] Mass of the atomic for relax
Álvaro Alves
- [Pw_forum] Mass of the atomic for relax
Paolo Giannozzi
- [Pw_forum] Mass of the atomic for relax
Álvaro Alves
- [Pw_forum] Calculation on zeolite
Peter Winey
- [Pw_forum] Calculation on zeolite
lan haiping
- [Pw_forum] Mass of the atomic for relax
Álvaro Alves
- [Pw_forum] Calculation on zeolite
Peter Winey
- [Pw_forum] zero energy reference
Ramiro Cardona
- [Pw_forum] where to find the difference bwtween new pre-release 4.0CVS version and older
xu yuehua
- [Pw_forum] make error when installing espresso-3.2.3 in linux machine
xu yuehua
- [Pw_forum] electron-phonon calculation
Chao
- [Pw_forum] Mass of the atomic for relax
Paolo Giannozzi
- [Pw_forum] make error when installing espresso-3.2.3 in linux machine
Paolo Giannozzi
- [Pw_forum] electron-phonon calculation
Paolo Giannozzi
- [Pw_forum] where to find the difference bwtween new pre-release 4.0CVS version and older
Paolo Giannozzi
- [Pw_forum] zero energy reference
Paolo Giannozzi
- [Pw_forum] make error when installing espresso-3.2.3 in linux machine
xu yuehua
- [Pw_forum] where to find the difference bwtween new pre-release 4.0CVS version and older
xu yuehua
- [Pw_forum] make error when installing espresso-3.2.3 in linux machine
Lorenzo Paulatto
- [Pw_forum] make error when installing espresso-3.2.3 in linux machine
Paolo Giannozzi
- [Pw_forum] make error when installing espresso-3.2.3 in linux machine
xu yuehua
- [Pw_forum] make error when installing espresso-3.2.3 in linux machine
Lorenzo Paulatto
- [Pw_forum] make error when installing espresso-3.2.3 in linux machine
lan haiping
- [Pw_forum] where to find the difference bwtween new pre-release 4.0CVS version and older
Paolo Giannozzi
- [Pw_forum] make error when installing espresso-3.2.3 in linux machine
xu yuehua
- [Pw_forum] pw.x stops with "Starting wfc are atomic"
zhs064
- [Pw_forum] pw.x stops with "Starting wfc are atomic"
Axel Kohlmeyer
- [Pw_forum] En: i/o erro in davcio
Álvaro Alves
- [Pw_forum] En: i/o erro in davcio
Axel Kohlmeyer
- [Pw_forum] En: i/o erro in davcio
Álvaro Alves
- [Pw_forum] compiling failer
程迎春
- [Pw_forum] compiling failer
Axel Kohlmeyer
- [Pw_forum] compiling failer
lan haiping
- [Pw_forum] pw error during compilation
sreekar guddeti
- [Pw_forum] pw error during compilation
Paolo Giannozzi
- [Pw_forum] Fwd: compiling failer
程迎春
- [Pw_forum] Fwd: compiling failer
Paolo Giannozzi
- [Pw_forum] Anti-ferromagnetic Problem
r95222066 at ntu.edu.tw
- [Pw_forum] Anti-ferromagnetic Problem
Paolo Giannozzi
- [Pw_forum] Magnetic Moment calculation for pdos.out file
r95222066 at ntu.edu.tw
- [Pw_forum] Pw_forum Digest, Vol 9, Issue 26
sreekar guddeti
- [Pw_forum] Pw_forum Digest, Vol 9, Issue 26
Paolo Giannozzi
- [Pw_forum] 回复: Re: electron-phonon calculation
Chao
- [Pw_forum] from projwfc : error # 90 (fwd)
Karoly Nemeth
- [Pw_forum] from projwfc : error # 90 (fwd)
Axel Kohlmeyer
- [Pw_forum] Spin-polarization plot
r95222066 at ntu.edu.tw
- [Pw_forum] Fermi-surface spin-polarization code ?
r95222066 at ntu.edu.tw
- [Pw_forum] Fermi-surface spin-polarization code ?
lan haiping
- [Pw_forum] from projwfc : error # 90 (fwd)
Paolo Giannozzi
- [Pw_forum] Fermi-surface spin-polarization code ?
Paolo Giannozzi
- [Pw_forum] the output of pwcond.x
程迎春
- [Pw_forum] the output of pwcond.x
lan haiping
- [Pw_forum] program modification of virtual.f90
yukihiro_okuno at fujifilm.co.jp
- [Pw_forum] error in relaxation
madhura at jncasr.ac.in
- [Pw_forum] why there is no code for the constant of e-p coupling for nonmetal?is there any difficulty for nonmetal?
xu yuehua
- [Pw_forum] why there is no code for the constant of e-p coupling for nonmetal?is there any difficulty for nonmetal?
Yansun Yao
- [Pw_forum] why there is no code for the constant of e-p couplingfor nonmetal?is there any difficulty for nonmetal?
Huiqun Zhou
- [Pw_forum] program modification of virtual.f90 2 (different riiner)
yukihiro_okuno at fujifilm.co.jp
- [Pw_forum] SIC in quantum-espresso
Agostino Migliore
- [Pw_forum] pain in running example
sreekar guddeti
- [Pw_forum] pain in running example
Axel Kohlmeyer
- [Pw_forum] pain in running example
Paolo Giannozzi
- [Pw_forum] error in relaxation
Paolo Giannozzi
- [Pw_forum] CaCuO2 and LDA+U
Chao Cao
- [Pw_forum] why there is no code for the constant of e-p couplingfor nonmetal?is there any difficulty for nonmetal?
Huiqun Zhou
- [Pw_forum] why there is no code for the constant of e-p couplingfor nonmetal?is there any difficulty for nonmetal?
xu yuehua
- [Pw_forum] Pw_forum Digest, Vol 9, Issue 31
sreekar guddeti
- [Pw_forum] Pw_forum Digest, Vol 9, Issue 31
Andrea Ferretti
- [Pw_forum] Pw_forum Digest, Vol 9, Issue 31
Axel Kohlmeyer
- [Pw_forum] (no subject)
Axel Kohlmeyer
- [Pw_forum] (no subject)
程迎春
- [Pw_forum] (no subject)
程迎春
- [Pw_forum] error when run example02 in 3.2.package
xu yuehua
- [Pw_forum] el-ph error in package3.2.3
xu yuehua
- [Pw_forum] error in relaxation
madhura at jncasr.ac.in
- [Pw_forum] (no subject)
Chao Cao
- [Pw_forum] error when run example02 in 3.2.package
lan haiping
- [Pw_forum] non collinear magnetism
Rudra Banerjee
- [Pw_forum] non collinear magnetism
lan haiping
- [Pw_forum] non collinear magnetism
Rudra Banerjee
- [Pw_forum] error when run example02 in 3.2.package
xu yuehua
- [Pw_forum] error when run example02 in 3.2.package
Axel Kohlmeyer
- [Pw_forum] program modification of virtual.f90
Stefano Baroni
- [Pw_forum] error in relaxation
Paolo Giannozzi
- [Pw_forum] SIC in quantum-espresso
Agostino Migliore
- [Pw_forum] CaCuO2 and LDA+U
Axel Kohlmeyer
- [Pw_forum] CaCuO2 and LDA+U
Chao Cao
- [Pw_forum] error when run example02 in 3.2.package
Huiqun Zhou
- [Pw_forum] el-ph error in package3.2.3
Dal Corso Andrea
- [Pw_forum] el-ph error in package3.2.3
xu yuehua
- [Pw_forum] el-ph error in package3.2.3
Dal Corso Andrea
- [Pw_forum] CaCuO2 and LDA+U
Matteo Cococcioni
- [Pw_forum] electron-phonon interaction
Li yan-ling
- [Pw_forum] electron-phonon interaction
Axel Kohlmeyer
- [Pw_forum] symmetry of phonon modes
Munima Bora Sahariah
- [Pw_forum] symmetry of phonon modes
Dal Corso Andrea
- [Pw_forum] electron-phonon interaction
Paolo Giannozzi
- [Pw_forum] k point selection.
Paolo Giannozzi
- [Pw_forum] problems on optimization
Jun Dai
- [Pw_forum] lsign = .true.
EG Kim
- [Pw_forum] problems on optimization
Stefano Baroni
- [Pw_forum] env variable for libgfortran.so.2
William J Brouwer
- [Pw_forum] lsign = .true.
Dal Corso Andrea
- [Pw_forum] env variable for libgfortran.so.2
lan haiping
- [Pw_forum] env variable for libgfortran.so.2
Ari P Seitsonen
- [Pw_forum] I/O problem on MPI?
Charles Chen
- [Pw_forum] env variable for libgfortran.so.2
Paolo Giannozzi
- [Pw_forum] Exceptionally large charge density cut-off
Subhradip Ghosh
- [Pw_forum] difference between P63 and P63/mmc space groups
wangjunjie1981_0
- [Pw_forum] SWCNT (6,6)
zahra sadat naghavi
- [Pw_forum] I cannot get my .dyn(m-n) file
herofather
- [Pw_forum] Post-doc position in materials modeling in Paris
Gilles Hug
- [Pw_forum] band energies
Helen
- [Pw_forum] band energies
Nicola Marzari
- [Pw_forum] band energies
Helen
- [Pw_forum] I cannot get my .dyn(m-n) file
Eyvaz Isaev
- [Pw_forum] I cannot get my .dyn(m-n) file
Viet Huy Nguyen
- [Pw_forum] I cannot get my .dyn(m-n) file
Viet Huy Nguyen
- [Pw_forum] I cannot get my .dyn(m-n) file
Rudra Banerjee
- [Pw_forum] I cannot get my .dyn(m-n) file
Viet Huy Nguyen
- [Pw_forum] lsign = .true.
EG Kim
- [Pw_forum] hartree potential
willy kohn
- [Pw_forum] hartree potential
Nicholas E. Singh-Miller
- [Pw_forum] hartree potential
willy kohn
Last message date:
Mon Mar 31 22:58:45 CEST 2008
Archived on: Wed Feb 28 11:02:46 CET 2018
This archive was generated by
Pipermail 0.09 (Mailman edition).