siesta-l  

Índice cronológico

• 2018/01/10 [SIESTA-L] optical properties and electronic transitions Sunetra Das
• 2018/01/09 [SIESTA-L] Structural Relaxation Fazle Subhan
• 2018/01/09 [SIESTA-L] fatbands for SOC Zeila Zanolli
• 2018/01/05 Re: [SIESTA-L] Fwd: problem with converging mesh-cutoff and K-grid points Najmeh Honari
• 2018/01/05 [SIESTA-L] Zinc Pseudopotential error RAJAN SINGH
• 2018/01/01 [SIESTA-L] Upcoming 4.0.2 and 4.1-b4 releases Nick Papior
• 2017/12/28 Re: [SIESTA-L] problem with converging mesh-cutoff and K-grid points Sunetra Das
• 2017/12/27 Re: [SIESTA-L] problem with converging mesh-cutoff and K-grid points Javier Junquera
• 2017/12/27 Re: [SIESTA-L] Fwd: problem with converging mesh-cutoff and K-grid points Andrei Postnikov
• 2017/12/26 [SIESTA-L] Unit of length for atomic positions Soumaia Djaadi
• 2017/12/26 Re: [SIESTA-L] Fwd: problem with converging mesh-cutoff and K-grid points Sunetra Das
• 2017/12/25 Re: [SIESTA-L] Fwd: problem with converging mesh-cutoff and K-grid points Andrei Postnikov
• 2017/12/24 [SIESTA-L] Fwd: problem with converging mesh-cutoff and K-grid points Najmeh Honari
• 2017/12/22 Re: [SIESTA-L] Compilation issues Jones de Andrade
• 2017/12/22 Re: [SIESTA-L] TBtrans netcdf Jean-Joseph Adjizian
• 2017/12/22 [SIESTA-L] Compilation issues Jones de Andrade
• 2017/12/22 Re: [SIESTA-L] error in parallel installation Sunetra Das
• 2017/12/22 Re: [SIESTA-L] 'Segmentation fault - invalid memory reference' when running siesta in parallel RCP
• 2017/12/21 [SIESTA-L] 'Segmentation fault - invalid memory reference' when running siesta in parallel Sunetra Das
• 2017/12/21 Re: [SIESTA-L] error in parallel installation Nick Papior
• 2017/12/21 Re: [SIESTA-L] error in parallel installation RCP
• 2017/12/20 Re: [SIESTA-L] How to model two electrons induced due to the chemical interaction Lukas Deuchler
• 2017/12/20 [SIESTA-L] error in parallel installation Sunetra Das
• 2017/12/19 [SIESTA-L] How to model two electrons induced due to the chemical interaction Nadia Salami
• 2017/12/19 Re: [SIESTA-L] Parallel SIESTA: segmentation error depending on the number of atoms and cores. Dmitriy Muzychenko
• 2017/12/19 Re: [SIESTA-L] Application of strain in SIESTA Максим Арсентьев
• 2017/12/18 [SIESTA-L] Application of strain in SIESTA Suman Chowdhury
• 2017/12/18 Re: [SIESTA-L] TBtrans netcdf Nick Papior
• 2017/12/18 Re: [SIESTA-L] Pseudopotential & block PAO.Basis of W (LDA and GGA) Koussay LAZAAR
• 2017/12/17 Re: [SIESTA-L] Unexpectedly Large Cell Volumes Patrick Avery
• 2017/12/15 [SIESTA-L] TBtrans netcdf Jean-Joseph Adjizian
• 2017/12/15 Re: [SIESTA-L] Pseudopotential & block PAO.Basis of W (LDA and GGA) Salvador Barraza-Lopez
• 2017/12/15 Re: [SIESTA-L] Unexpectedly Large Cell Volumes Nick Papior
• 2017/12/14 [SIESTA-L] Pseudopotential & block PAO.Basis of W (LDA and GGA) Koussai LAZAAR
• 2017/12/14 Re: [SIESTA-L] Parallel SIESTA: segmentation error depending on the number of atoms and cores. Peter Koval
• 2017/12/14 Re: [SIESTA-L] Parallel SIESTA: segmentation error depending on the number of atoms and cores. Nick Papior
• 2017/12/14 [SIESTA-L] Unexpectedly Large Cell Volumes Patrick Avery
• 2017/12/13 [SIESTA-L] Parallel SIESTA: segmentation error depending on the number of atoms and cores. Dmitriy Muzychenko
• 2017/12/11 [SIESTA-L] Imaginary part of the wave function KAREEKUNNAN Afsal
• 2017/12/10 [SIESTA-L] Fw: Optical calculations ‪mohadeseh mehmandoost‬ ‪
• 2017/12/09 [SIESTA-L] Optical calculations ‪mohadeseh mehmandoost‬ ‪
• 2017/12/09 Re: [SIESTA-L] error with siesta-4.1-b3 sauluck
• 2017/12/08 [SIESTA-L] error with siesta-4.1-b3 pablod
• 2017/12/06 Re: [SIESTA-L] Transiesta calculations with different electrode temperatures Krzysztof Zberecki
• 2017/12/06 Re:[SIESTA-L] HOW TO APPLY GATE VOLTAGE? 南京理工大学__孙玉
• 2017/12/05 Re: [SIESTA-L] HOW TO APPLY GATE VOLTAGE? Nick Papior
• 2017/12/04 Re: [SIESTA-L] Transiesta calculations with different electrode temperatures Nick Papior
• 2017/12/02 [SIESTA-L] Orbital angular momentum in siesta Maciej Szary
• 2017/12/02 [SIESTA-L] Transiesta calculations with different electrode temperatures Krzysztof Zberecki
• 2017/11/30 [SIESTA-L] Blyp psf for Silicon Francisco Garcia
• 2017/11/30 Re: [SIESTA-L] Structural relaxation of 2D carbon atom chain Andrei Postnikov
• 2017/11/29 [SIESTA-L] Structural relaxation of 2D carbon atom chain Tomasz Kepczynski
• 2017/11/27 [SIESTA-L] spin-orbit coupling (SOC) Koussai LAZAAR
• 2017/11/25 Re: [SIESTA-L] USPEX and SIESTA Rishi Sreedhar
• 2017/11/24 [SIESTA-L] MaX newsletter November 2017 Pablo Ordejón
• 2017/11/24 Re:[SIESTA-L] HOW TO APPLY GATE VOLTAGE? 南京理工大学__孙玉
• 2017/11/24 Re: [SIESTA-L] USPEX and SIESTA zb . nojini
• 2017/11/24 Re: [SIESTA-L] USPEX and SIESTA RCP
• 2017/11/23 Re: [SIESTA-L] doping I. Camps
• 2017/11/23 [SIESTA-L] USPEX and SIESTA Rishi Sreedhar
• 2017/11/23 Re: [SIESTA-L] Help regarding pdosxml and Eig2dos utility Mostafa Shabani
• 2017/11/22 [SIESTA-L] Definition of spin-polarized calculation for open-shell molecules in SIESTA/TRANSIESTA Esmaeil Farajpour Bonab
• 2017/11/22 Re: [SIESTA-L] Mulliken charge calculation I. Camps
• 2017/11/21 [SIESTA-L] doping masoudeh maleki
• 2017/11/21 [SIESTA-L] Mulliken charge calculation BISWAJIT BALL
• 2017/11/21 [SIESTA-L] Help regarding pdosxml and Eig2dos utility BISWAJIT BALL
• 2017/11/20 [SIESTA-L] Pseudopotential for Actinides Esmaeil Farajpour Bonab
• 2017/11/20 Re: [SIESTA-L] Piezoeletric effect of PZT Emilio Artacho
• 2017/11/20 [SIESTA-L] Fwd: doping masoudeh maleki
• 2017/11/20 [SIESTA-L] [***Posible SPAM***]Sin Asunto/Subject is blank masoudeh maleki
• 2017/11/18 Re: [SIESTA-L] Piezoeletric effect of PZT Pawan Yadav
• 2017/11/18 Re: [SIESTA-L] DM_out and segmentation error 王亮
• 2017/11/17 Re: [SIESTA-L] DM_out and segmentation error Nick Papior
• 2017/11/17 Re: [SIESTA-L] Molecular Adsorption on Material Surfaces Matías Soto C .
• 2017/11/16 [SIESTA-L] Determination of Spin-Orbit strength Suman Chowdhury
• 2017/11/16 Re: [SIESTA-L] Molecular Adsorption on Material Surfaces Rishi Sreedhar
• 2017/11/15 Re: [SIESTA-L] DM_out and segmentation error Nick Papior
• 2017/11/15 Re: [SIESTA-L] Defining periodic structure Mostafa Shabani
• 2017/11/15 Re: [SIESTA-L] Molecular Adsorption on Material Surfaces Lukas Deuchler
• 2017/11/15 Re: [SIESTA-L] Defining periodic structure Nick Papior
• 2017/11/14 [SIESTA-L] DM_out and segmentation error 王亮
• 2017/11/14 Re: [SIESTA-L] Molecular Adsorption on Material Surfaces Rishi Sreedhar
• 2017/11/14 [SIESTA-L] Piezoeletric effect of PZT Pawan Yadav
• 2017/11/14 Re: [SIESTA-L] Molecular Adsorption on Material Surfaces Rishi Sreedhar
• 2017/11/14 [SIESTA-L] Defining periodic structure Harsh Shah
• 2017/11/13 [SIESTA-L] [***Posible SPAM***]Sin Asunto/Subject is blank Harsh Shah
• 2017/11/13 Re: [SIESTA-L] Molecular Adsorption on Material Surfaces Matías Soto C .
• 2017/11/13 Re: [SIESTA-L] Molecular Adsorption on Material Surfaces Lukas Deuchler
• 2017/11/12 [SIESTA-L] Molecular Adsorption on Material Surfaces Rishi Sreedhar
• 2017/11/09 Re: [SIESTA-L] ballistic transport fomin
• 2017/11/09 Re: [SIESTA-L] HOW TO APPLY GATE VOLTAGE? Leonardo Fonseca
• 2017/11/08 Re: [SIESTA-L] HOW TO APPLY GATE VOLTAGE? Leonardo Fonseca
• 2017/11/08 [SIESTA-L] ballistic transport Zara Nosh
• 2017/11/08 Re: [SIESTA-L] HOW TO APPLY GATE VOLTAGE? Nick Papior
• 2017/11/07 Re: [SIESTA-L] error in transiesta running Nick Papior
• 2017/11/07 [SIESTA-L] HOW TO APPLY GATE VOLTAGE? 南京理工大学__孙玉
• 2017/11/07 Re: [SIESTA-L] Seeking your kind help to solve errors in Transiesta run Esmaeil Farajpour Bonab
• 2017/11/06 Re: [SIESTA-L] slow performance of TBTrans software in workstation with gcc compiler Nick Papior
• 2017/11/06 Re: [SIESTA-L] error in transiesta running Farzaneh Farzadi
• 2017/11/06 Re: [SIESTA-L] Seeking your kind help to solve errors in Transiesta run Bibhas Manna
• 2017/11/03 Re: [SIESTA-L] error in transiesta running Esmaeil Farajpour Bonab
• 2017/11/03 Re: [SIESTA-L] error in transiesta running Nick Papior
• 2017/11/03 Re: [SIESTA-L] slow performance of TBTrans software in workstation with gcc compiler Ankita Joshi
• 2017/11/02 [SIESTA-L] error in transiesta running Farzaneh Farzadi
• 2017/11/01 Re: [SIESTA-L] Problem restarting transiesta job Nick Papior
• 2017/11/01 Re: [SIESTA-L] << Intel vs AMD >> I. Camps
• 2017/10/31 Re: [SIESTA-L] Problem restarting transiesta job Ankita Joshi
• 2017/10/31 Re: [SIESTA-L] << Big system with SIESTA >> Nick Papior
• 2017/10/31 Re: [SIESTA-L] << Intel vs AMD >> Nick Papior
• 2017/10/30 [SIESTA-L] << Intel vs AMD >> I. Camps
• 2017/10/30 [SIESTA-L] << Big system with SIESTA >> I. Camps
• 2017/10/25 [SIESTA-L] Postdoc position for DFT + DMFT Pablo Ordejón
• 2017/10/25 [SIESTA-L] Bond current Zara Nosh
• 2017/10/25 Re: [SIESTA-L] [***Posible SPAM***]Sin Asunto/Subject is blank Farzaneh Farzadi
• 2017/10/24 Re: [SIESTA-L] [***Posible SPAM***]Sin Asunto/Subject is blank Mostafa Shabani
• 2017/10/24 Re: [SIESTA-L] [***Posible SPAM***]Sin Asunto/Subject is blank Mostafa Shabani
• 2017/10/24 [SIESTA-L] SCAN+rvv10 functional Antonio Cammarata
• 2017/10/24 Re: [SIESTA-L] [***Posible SPAM***]Sin Asunto/Subject is blank Nick Papior
• 2017/10/23 [SIESTA-L] [***Posible SPAM***]Sin Asunto/Subject is blank Farzaneh Farzadi
• 2017/10/21 Re: [SIESTA-L] potential barrier Zara Nosh
• 2017/10/21 Re: [SIESTA-L] Seeking your kind help to solve errors in Transiesta run Leonardo Fonseca
• 2017/10/20 Re: [SIESTA-L] potential barrier Javier Junquera
• 2017/10/20 [SIESTA-L] Seeking your kind help to solve errors in Transiesta run Bibhas Manna
• 2017/10/16 Re: [SIESTA-L] Problem in compiling siesta 4.1-b3 (with parallel processes) Nick Papior
• 2017/10/16 [SIESTA-L] Denchar with SIESTA 4.1-b1 cornil david
• 2017/10/14 Re: [SIESTA-L] current- voltage curve Farzaneh Farzadi
• 2017/10/14 [SIESTA-L] Problem in compiling siesta 4.1-b3 (with parallel processes) Bibhas Manna
• 2017/10/14 Re: [SIESTA-L] potential barrier Leonardo Fonseca
• 2017/10/13 [SIESTA-L] potential barrier Zara Nosh
• 2017/10/13 Re: [SIESTA-L] current- voltage curve Nick Papior
• 2017/10/12 Re: [SIESTA-L] Mulliken Charges on Water Ulrich Biedermann
• 2017/10/12 Re: [SIESTA-L] Few doubts in I-V calculation using TBTrans Nick Papior
• 2017/10/12 [SIESTA-L] Few doubts in I-V calculation using TBTrans Bibhas Manna
• 2017/10/12 Re: [SIESTA-L] current- voltage curve Farzaneh Farzadi
• 2017/10/11 [SIESTA-L] transmission pathway Zara Nosh
• 2017/10/11 Re: [SIESTA-L] Seeking your kind help in execution of TBTrans Nick Papior
• 2017/10/11 Re: [SIESTA-L] current- voltage curve Nick Papior
• 2017/10/11 Re: [SIESTA-L] transmission pathway Zara Nosh
• 2017/10/11 Re: [SIESTA-L] Mulliken Charges on Water Dan Gil
• 2017/10/11 [SIESTA-L] Fwd: current- voltage curve Farzaneh Farzadi
• 2017/10/10 Re: [SIESTA-L] Mulliken Charges on Water I. Camps
• 2017/10/10 [SIESTA-L] current- voltage curve Farzaneh Farzadi
• 2017/10/10 [SIESTA-L] Seeking your kind help in execution of TBTrans Bibhas Manna
• 2017/10/10 Re: [SIESTA-L] Problem in installing Transisesta Bibhas Manna
• 2017/10/09 Re: [SIESTA-L] optical gap Koussay LAZAAR
• 2017/10/09 Re: [SIESTA-L] electrostatic potential Zara Nosh
• 2017/10/09 Re: [SIESTA-L] Problem in installing Transisesta Nick Papior
• 2017/10/09 Re: [SIESTA-L] Mulliken Charges on Water Ulrich Biedermann
• 2017/10/08 Re: [SIESTA-L] Doping Andrei Postnikov
• 2017/10/08 [SIESTA-L] Problem in installing Transisesta Bibhas Manna
• 2017/10/08 Re: [SIESTA-L] Doping Andrei Postnikov
• 2017/10/07 Re: [SIESTA-L] Doping masoudeh maleki
• 2017/10/07 Re: [SIESTA-L] Mulliken Charges on Water Xiaozhou Shen
• 2017/10/06 [SIESTA-L] Mulliken Charges on Water Dan Gil
• 2017/10/06 Re: [SIESTA-L] electrostatic potential Nick Papior
• 2017/10/05 [SIESTA-L] electrostatic potential Zara Nosh
• 2017/10/05 Re: [SIESTA-L] << meaning Transiesta Example files >> Nick Papior
• 2017/10/05 Re: [SIESTA-L] Internal auxiliary supercell Nick Papior
• 2017/10/04 [SIESTA-L] << meaning Transiesta Example files >> I. Camps
• 2017/10/04 Re[2]: [SIESTA-L] Internal auxiliary supercell Muhammad Shadman
• 2017/10/03 [SIESTA-L] voltage drop Zara Nosh
• 2017/10/03 Re: [SIESTA-L] Internal auxiliary supercell Nick Papior
• 2017/10/02 [SIESTA-L] Internal auxiliary supercell Muhammad Shadman
• 2017/10/02 Re: [SIESTA-L] optical gap Peter Koval
• 2017/09/30 [SIESTA-L] optical gap Koussai LAZAAR
• 2017/09/30 Re: [SIESTA-L] Failed to generate .nc file in running tbtrans calculation Nick Papior
• 2017/09/29 [SIESTA-L] Failed to generate .nc file in running tbtrans calculation Ankita Joshi
• 2017/09/29 Re: [SIESTA-L] parallel installation of netcdf4 nasrin estaji
• 2017/09/29 Re: [SIESTA-L] error running calculations using parallel tbtrans with netcdf4 support Nick Papior
• 2017/09/29 Re: [SIESTA-L] parallel installation of netcdf4 Nick Papior
• 2017/09/28 [SIESTA-L] error running calculations using parallel tbtrans with netcdf4 support Ankita Joshi
• 2017/09/28 Re: [SIESTA-L] parallel installation of netcdf4 Ankita Joshi
• 2017/09/27 Re: [SIESTA-L] parallel installation of netcdf4 Nick Papior
• 2017/09/27 Re: [SIESTA-L] Doping Andrei Postnikov
• 2017/09/27 Re: [SIESTA-L] parallel installation of netcdf4 Rajesh Thakur
• 2017/09/27 Re: [SIESTA-L] Is it Possible to make a movie in SIESTA? Rishi Sreedhar
• 2017/09/26 Re: [SIESTA-L] Is it Possible to make a movie in SIESTA? Rafi Ullah
• 2017/09/26 Re: [SIESTA-L] Is it Possible to make a movie in SIESTA? Nick Papior
• 2017/09/26 [SIESTA-L] Doping masoudeh maleki
• 2017/09/26 [SIESTA-L] parallel installation of netcdf4 Ankita Joshi
• 2017/09/26 Re: [SIESTA-L] asterisks and NAN in output Alberto Garcia
• 2017/09/26 Re: [SIESTA-L] Is it Possible to make a movie in SIESTA? Ulrich Biedermann
• 2017/09/26 Re: [SIESTA-L] Is it Possible to make a movie in SIESTA? Andrei Postnikov
• 2017/09/26 [SIESTA-L] BSSE calculations eft rsd
• 2017/09/26 Re: [SIESTA-L] asterisks and NAN in output Andrei Postnikov
• 2017/09/26 Re: [SIESTA-L] Is it Possible to make a movie in SIESTA? RCP
• 2017/09/25 [SIESTA-L] asterisks and NAN in output Mochena, Mogus D.
• 2017/09/25 Re: [SIESTA-L] help RCP
• 2017/09/25 [SIESTA-L] Is it Possible to make a movie in SIESTA? Rishi Sreedhar
• 2017/09/24 Re: [SIESTA-L] Parallel version of TBTrans with Netcdf4 support Nick Papior
• 2017/09/24 Re: [SIESTA-L] help nasrin estaji
• 2017/09/23 Re: [SIESTA-L] Problem in transiesta run Ankita Joshi
• 2017/09/23 [SIESTA-L] Parallel version of TBTrans with Netcdf4 support Ankita Joshi
• 2017/09/23 Re: [SIESTA-L] help RCP
• 2017/09/22 [SIESTA-L] help nasrin estaji
• 2017/09/22 Re: [SIESTA-L] Problem in transiesta run Nick Papior
• 2017/09/21 [SIESTA-L] How to get the wave function KAREEKUNNAN Afsal
• 2017/09/20 [SIESTA-L] Problem in transiesta run Ankita Joshi
• 2017/09/20 Re: [SIESTA-L] Structure optimization Максим Арсентьев
• 2017/09/20 Re: [SIESTA-L] Structure optimization Nick Papior

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