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• 2008/01/21 [SIESTA-L] optimized babsis for Au? Cherry Y. Yates
• 2008/01/19 [SIESTA-L] madani samah
• 2008/01/18 Re: [SIESTA-L] total charge density Oleksandr Voznyy
• 2008/01/17 [SIESTA-L] Pseudo potentials for P and F Min Seung Kyu
• 2008/01/17 Re: [SIESTA-L] total charge density Sungjong Woo
• 2008/01/16 Re: [SIESTA-L] extraction of .pdos with utility of pdos in version2.0 Marcos Verissimo Alves
• 2008/01/16 Re: [SIESTA-L] extraction of .pdos with utility of pdos in version2.0 Alexandre Lebon
• 2008/01/16 [SIESTA-L] denchar Lamjed Debbichi
• 2008/01/16 Re: [SIESTA-L] XCrysden and Denchar Output Thomas Sadowski
• 2008/01/16 Re: [SIESTA-L] extraction of .pdos with utility of pdos in version 2.0 Marcos Verissimo Alves
• 2008/01/16 Re: [SIESTA-L] extraction of .pdos with utility of pdos in version 2.0 N H
• 2008/01/16 [SIESTA-L] extraction of .pdos with utility of pdos in version 2.0 Alexandre Lebon
• 2008/01/16 Re: [SIESTA-L] Reading error in atom.f Alexandre Lebon
• 2008/01/15 Re: [SIESTA-L] Geometry of a transition state Oleksandr Voznyy
• 2008/01/15 Re: [SIESTA-L] Geometry of a transition state Marcos Verissimo Alves
• 2008/01/15 [SIESTA-L] Geometry of a transition state Abramov, Alexander V
• 2008/01/14 Re: [SIESTA-L] XCrysden and Denchar Output reza behnam
• 2008/01/12 [SIESTA-L] Follow-up on all-electron calculations for O - bug? Marcos Verissimo Alves
• 2008/01/12 [SIESTA-L] Doubts in all-electron calculations for O Marcos Verissimo Alves
• 2008/01/11 [SIESTA-L] Posible SPAM: Re: [SIESTA-L] XCrysden and Denchar Output Oleksandr Voznyy
• 2008/01/11 [SIESTA-L] XCrysden and Denchar Output Thomas Sadowski
• 2008/01/11 [SIESTA-L] Logarithmic grids Marcos Verissimo Alves
• 2008/01/10 Re: [SIESTA-L] Max. Energy range Martin Blaber
• 2008/01/10 Re: [SIESTA-L] list RH Miwa
• 2008/01/10 [SIESTA-L] Getting charge density from denchar Sungjong Woo
• 2008/01/10 Re: [SIESTA-L] list RH Miwa
• 2008/01/10 [SIESTA-L] list RH Miwa
• 2008/01/10 Re: [SIESTA-L] total charge density Oleksandr Voznyy
• 2008/01/10 Re: [SIESTA-L] total charge density Yurko Natanzon
• 2008/01/10 [SIESTA-L] total charge density Sungjong Woo
• 2008/01/10 [SIESTA-L] Max. Energy range vikas thakur
• 2008/01/10 [SIESTA-L] [Fwd: [Campos] İlt: PSEUDOPOT (pl ease help me )] Marcin Dulak
• 2008/01/08 Re: [SIESTA-L] question about binding eneriges Marcos Verissimo Alves
• 2008/01/08 [SIESTA-L] question about binding eneriges Pablo Denis
• 2008/01/08 [SIESTA-L] Ni GGA or LAD pseudopotential Shi, Ning
• 2008/01/06 [SIESTA-L] MD.ATforPhonon block vikas sharma
• 2008/01/06 [SIESTA-L] MD.ATforPhonon block vikas sharma
• 2008/01/05 [SIESTA-L] Optical calculations vikas thakur
• 2008/01/03 [SIESTA-L] Mn3+ pseudopotential Dai Jun
• 2008/01/01 [SIESTA-L] Compiling and Converting .RHO to .XSF Eric Sadani
• 2008/01/01 [SIESTA-L] Compiling and Converting .RHO to .XSF Eric Sadani
• 2007/12/26 Re: [SIESTA-L] Molecular binding energy Marcos Verissimo Alves
• 2007/12/26 [SIESTA-L] Molecular binding energy John Appleton
• 2007/12/22 Re: [SIESTA-L] Differences in the spin polarization Vasilii Artyukhov
• 2007/12/22 Re: [SIESTA-L] Differences in the spin polarization Roberto Sapiens
• 2007/12/22 Re: [SIESTA-L] Differences in the spin polarization Vasilii Artyukhov
• 2007/12/22 [SIESTA-L] Differences in the spin polarization Roberto Sapiens
• 2007/12/21 Re: [SIESTA-L] Strange results for charge density Alberto Garcia
• 2007/12/20 Re: [SIESTA-L] [Fwd: Strange results for charge density] Oleksandr Voznyy
• 2007/12/20 Re: [SIESTA-L] dipole moment vs. Mulliken populations of a watermolecule Oleksandr Voznyy
• 2007/12/20 [SIESTA-L] [Fwd: Strange results for charge density] Marcos Verissimo Alves
• 2007/12/20 [SIESTA-L] Strange results for charge density Marcos Verissimo Alves
• 2007/12/20 Re: [SIESTA-L] dipole moment vs. Mulliken populations of a watermolecule Marcos Verissimo Alves
• 2007/12/20 Re: [SIESTA-L] dipole moment vs. Mulliken populations of a watermolecule Sungjong Woo
• 2007/12/20 [SIESTA-L] GGA PBE pseudopotentials for Cr,V,Mg,O X. Feng
• 2007/12/20 Re: [SIESTA-L] Atomic energies and BSSE Marcos Verissimo Alves
• 2007/12/19 [SIESTA-L] Atomic energies and BSSE John Appleton
• 2007/12/19 Re: [SIESTA-L] dipole moment vs. Mulliken populations of a watermolecule Oleksandr Voznyy
• 2007/12/18 Re: [SIESTA-L] Mesh Cutoff Emilio Artacho
• 2007/12/18 [SIESTA-L] dipole moment vs. Mulliken populations of a water molecule Sungjong Woo
• 2007/12/18 [SIESTA-L] Mesh Cutoff N H
• 2007/12/17 Re: [SIESTA-L] Au pseudopotential for Au Kamaram Munira
• 2007/12/16 [SIESTA-L] How to add nonlinear external potential to Siesta calculation Jingbin Li
• 2007/12/14 Re: [SIESTA-L] psf format X. Feng
• 2007/12/13 Re: [SIESTA-L] Electron occupancies in SIESTA Nichols A. Romero
• 2007/12/13 Re: [SIESTA-L] psf format Nichols A. Romero
• 2007/12/13 [SIESTA-L] Electron occupancies in SIESTA Salvador Barraza-Lopez
• 2007/12/13 [SIESTA-L] psf format X. Feng
• 2007/12/13 [SIESTA-L] Au pseudopotential for Au Mousumi Upadhyay Kahaly
• 2007/12/12 [SIESTA-L] phonon frequency in Vibra bipul rakshit
• 2007/12/11 [SIESTA-L] PAO.Basis for Cu(111) reza behnam
• 2007/12/10 [SIESTA-L] SIESTA convergency problem Abramov, Alexander V
• 2007/12/07 Re: [SIESTA-L] Example fdf file for bulk hcp structurecalculation Engin Deligoz
• 2007/12/07 Re: [SIESTA-L] Example fdf file for bulk hcp structurecalculation Kamaram Munira
• 2007/12/07 Re: [SIESTA-L] Example fdf file for bulk hcp structure calculation Giacomo Giorgi
• 2007/12/06 [SIESTA-L] Example fdf file for bulk hcp structure calculation Kamaram Munira
• 2007/12/04 [SIESTA-L] Neptinium(Np) GOKHAN SURUCU
• 2007/12/03 Re: [SIESTA-L] HS matrix. 박준호
• 2007/12/03 [SIESTA-L] HS matrix. Kamaram Munira
• 2007/12/03 [SIESTA-L] Pseudopotantial Np GOKHAN SURUCU
• 2007/12/02 [SIESTA-L] How to plus a diffuse 3s orbit for the valence electrons. Zhu Xi
• 2007/12/01 Re: [SIESTA-L] how to see the plots of generated psuedopotentials vikas thakur
• 2007/11/30 Re: [SIESTA-L] Problem FixSpin apostnik
• 2007/11/30 Re: [SIESTA-L] pseudopotential for Ga and As lan haiping
• 2007/11/29 [SIESTA-L] pseudopotential for Ga and As Cherry Y. Yates
• 2007/11/29 Re: [SIESTA-L] Problem FixSpin Marcos Verissimo Alves
• 2007/11/29 Fwd: [SIESTA-L] Errors due to Cr pseudopotential Alberto Garcia
• 2007/11/29 Re: [SIESTA-L] Errors due to Cr pseudopotential Semichaevsky, Andrey
• 2007/11/29 [SIESTA-L] how to see the plots of generated psuedopotentials vikas sharma
• 2007/11/29 [SIESTA-L] all electron calculation of Y atom vikas sharma
• 2007/11/29 Re: [SIESTA-L] Need help with H and Si Basis sets for nanowire N H
• 2007/11/28 Re: [SIESTA-L] Need help with H and Si Basis sets for nanowire Oleksandr Voznyy
• 2007/11/28 [SIESTA-L] Need help with H and Si Basis sets for nanowire Abraham Hmiel
• 2007/11/28 Re: [SIESTA-L] Problem FixSpin Andrei Postnikov
• 2007/11/28 Re: [SIESTA-L] Problem FixSpin Vasilii Artyukhov
• 2007/11/28 Re: [SIESTA-L] Problem FixSpin Andrei Postnikov
• 2007/11/28 Re: [SIESTA-L] Optical calculation Engin Deligoz
• 2007/11/28 Re: [SIESTA-L] Problem FixSpin Marcos Verissimo Alves
• 2007/11/28 [SIESTA-L] Problem FixSpin Eliseo Ruiz
• 2007/11/27 [SIESTA-L] Optical calculation vikas thakur
• 2007/11/27 Re: [SIESTA-L] Pseudopotential testing Salvador Barraza-Lopez
• 2007/11/27 Re: [SIESTA-L] Pseudopotential testing Demetra Psiachos
• 2007/11/27 [SIESTA-L] Pseudopotential testing Ian Shuttleworth
• 2007/11/26 Re: [SIESTA-L] problems compiling siesta-2.0 IBM p575 Jyh-Shyong
• 2007/11/26 [SIESTA-L] problems compiling siesta-2.0 IBM p575 Jacques Plevert
• 2007/11/26 Re: [SIESTA-L] PP for Co and W ???
• 2007/11/26 [SIESTA-L] PP for Co and W reza behnam
• 2007/11/24 Re: [SIESTA-L] Ti Pseudopotential lan haiping
• 2007/11/24 Re: [SIESTA-L] Ti Pseudopotential Hui Tang
• 2007/11/24 Re: [SIESTA-L] Ti Pseudopotential Zeila Zanolli
• 2007/11/24 Re: [SIESTA-L] Ti Pseudopotential lan haiping
• 2007/11/23 [SIESTA-L] Ti Pseudopotential M.Sairam Swaroop
• 2007/11/23 Re: [SIESTA-L] Energy Band Gap Oleksandr Voznyy
• 2007/11/22 Re: [SIESTA-L] Energy Band Gap vikas thakur
• 2007/11/22 Re: [SIESTA-L] Energy Band Gap 杨福华
• 2007/11/22 Re: [SIESTA-L] Energy Band Gap Marcos Verissimo Alves
• 2007/11/21 Re: [SIESTA-L] Energy Band Gap 杨福华
• 2007/11/21 [SIESTA-L] question about source code in subroutine phiatm() in atmfuncs.f Jingbin Li
• 2007/11/21 Re: [SIESTA-L] Energy Band Gap Marcos Verissimo Alves
• 2007/11/21 [SIESTA-L] Energy Band Gap vikas thakur
• 2007/11/20 [SIESTA-L] psf and input file for Co and W atoms reza behnam
• 2007/11/19 [SIESTA-L] FLAGS for compiling Apostnikov *.f files zubaer
• 2007/11/19 Re: [SIESTA-L] soft confinement Oleksandr Voznyy
• 2007/11/16 [SIESTA-L] How to choose right parameters for generating pseudopotentials? X. Feng
• 2007/11/15 Re: [SIESTA-L] Convergence in surfaces Yong Liu
• 2007/11/15 Re: [SIESTA-L] pseudopotential for gold (Au) Cherry Y. Yates
• 2007/11/15 Re: [SIESTA-L] pseudopotential for gold (Au) Varadharajan Srinivasan
• 2007/11/15 [SIESTA-L] pseudopotential for gold (Au) Cherry Y. Yates
• 2007/11/15 [SIESTA-L] Convergence in surfaces N H
• 2007/11/15 [SIESTA-L] soft confinement Heribert Reis
• 2007/11/14 Re: [SIESTA-L] PDOS Marcos Verissimo Alves
• 2007/11/14 [SIESTA-L] PDOS Salvador Barraza-Lopez
• 2007/11/13 Re: [SIESTA-L] PDOS file Marcos Verissimo Alves
• 2007/11/13 Re: [SIESTA-L] PDOS file David Strubbe
• 2007/11/13 Re: [SIESTA-L] PDOS file Marcos Verissimo Alves
• 2007/11/13 [SIESTA-L] PDOS file Salvador Barraza-Lopez
• 2007/11/13 Re: [SIESTA-L] Rare-gaz pseudo vikas thakur
• 2007/11/13 [SIESTA-L] Rare-gaz pseudo cornil david
• 2007/11/12 Re: [SIESTA-L] Influence of basis set Oleksandr Voznyy
• 2007/11/12 Re: [SIESTA-L] Influence of basis set N H
• 2007/11/12 Re: [SIESTA-L] Influence of basis set Marcos Verissimo Alves
• 2007/11/12 Re: [SIESTA-L] Influence of basis set Oleksandr Voznyy
• 2007/11/12 [SIESTA-L] Influence of basis set Marcos Verissimo Alves
• 2007/11/10 Re: [SIESTA-L] Atomic forces vikas thakur
• 2007/11/09 Re: [SIESTA-L] Atomic forces Oleksandr Voznyy
• 2007/11/09 Re: [SIESTA-L] A magnetic structure going nonmagnetic Vasilii Artyukhov
• 2007/11/09 Re: [SIESTA-L] Atomic forces zubaer
• 2007/11/09 Re: [SIESTA-L] Atomic forces Oleksandr Voznyy
• 2007/11/09 Re: [SIESTA-L] Atomic forces Oleksandr Voznyy
• 2007/11/09 [SIESTA-L] DENCHAR - Sorry Thomas Sadowski
• 2007/11/09 [SIESTA-L] Denchar Compilation Thomas Sadowski
• 2007/11/09 Re: [SIESTA-L] Atomic forces vikas thakur
• 2007/11/09 Re: [SIESTA-L] A magnetic structure going nonmagnetic Marcos Verissimo Alves
• 2007/11/09 Re: [SIESTA-L] U pseudo Marcos Verissimo Alves
• 2007/11/09 Re: [SIESTA-L] Atomic forces Simon Dubois
• 2007/11/09 Re: [SIESTA-L] Atomic forces vikas thakur
• 2007/11/08 Re: [SIESTA-L] Atomic forces vikas thakur
• 2007/11/08 Re: [SIESTA-L] A magnetic structure going nonmagnetic Gul Rahman
• 2007/11/08 Re: [SIESTA-L] U pseudo Carlos Pinilla
• 2007/11/08 Re: [SIESTA-L] Atomic forces zubaer
• 2007/11/08 [SIESTA-L] A magnetic structure going nonmagnetic Vasilii Artyukhov
• 2007/11/08 Re: [SIESTA-L] U pseudo Marcos Verissimo Alves
• 2007/11/08 Re: [SIESTA-L] Atomic forces Oleksandr Voznyy
• 2007/11/08 [SIESTA-L] rho2xsf apostnik
• 2007/11/08 [SIESTA-L] U pseudo Carlos
• 2007/11/08 Re: [SIESTA-L] Atomic forces Simon Dubois
• 2007/11/08 Re: [SIESTA-L] Atomic forces vikas thakur
• 2007/11/07 Re: [SIESTA-L] Atomic forces zubaer
• 2007/11/06 Re: [SIESTA-L] Atomic forces vikas thakur
• 2007/11/06 Re: [SIESTA-L] Atomic forces vikas thakur
• 2007/11/06 [SIESTA-L] Atomic forces Ian Shuttleworth
• 2007/11/03 Re: [SIESTA-L] Molecular Dynamics In siesta Andrei Postnikov
• 2007/11/01 [SIESTA-L] Molecular Dynamics In siesta M.Sairam Swaroop
• 2007/11/01 [SIESTA-L] Marcel Mohr
• 2007/10/31 [SIESTA-L] Charged System navaratnarajah kuganathan
• 2007/10/30 Re: [SIESTA-L] lan haiping
• 2007/10/30 Re: [SIESTA-L] Problem with optical properties N H
• 2007/10/30 [SIESTA-L] 寇良志
• 2007/10/29 Re: [SIESTA-L] Problem with optical properties Yurko Natanzon
• 2007/10/29 Re: [SIESTA-L] The unit in Siesta N H
• 2007/10/29 [SIESTA-L] Problem with optical properties N H
• 2007/10/29 Re: [SIESTA-L] The unit in Siesta N H
• 2007/10/29 [SIESTA-L] The unit in Siesta Jingbin Li
• 2007/10/28 [SIESTA-L] Harris energy Ian Shuttleworth
• 2007/10/26 [SIESTA-L] Au pseudo and basis Luis Agapito
• 2007/10/26 [SIESTA-L] Pseudopotential for Uranium Carlos
• 2007/10/26 Re: [SIESTA-L] UseStructFile Yurko Natanzon
• 2007/10/26 [SIESTA-L] UseStructFile bipul rakshit
• 2007/10/24 Re: [SIESTA-L] parallel over orbitals Mariusz Krawiec
• 2007/10/24 Re: [SIESTA-L] RE : [SIESTA-L] Number of integration points Oleksandr Voznyy
• 2007/10/24 Re: [SIESTA-L] parallel over orbitals Oleksandr Voznyy
• 2007/10/24 Re: [SIESTA-L] Pseudopotential vikas thakur
• 2007/10/24 [SIESTA-L] all electron calculation of Y atom vikas sharma
• 2007/10/24 Re: [SIESTA-L] error in reading .xsf apostnik
• 2007/10/23 [SIESTA-L] error in reading .xsf vikas thakur
• 2007/10/23 [SIESTA-L] Pseudopotential John Appleton
• 2007/10/23 [SIESTA-L] parallel over orbitals Mariusz Krawiec
• 2007/10/23 [SIESTA-L] Error on runing SIESTA in diferente machines N H
• 2007/10/22 [SIESTA-L] total energy zubaer
• 2007/10/21 [SIESTA-L] point charges renhui zheng

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