July 2021 Archives by date

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Starting: Thu Jul 1 09:53:43 CEST 2021
Ending: Sat Jul 31 13:48:57 CEST 2021
Messages: 138

[QE-users] "a" "b" values in "xanes.save" show "NaN" in xspectra calculation Lorenzo Paulatto
[QE-users] "a" "b" values in "xanes.save" show "NaN" in xspectra calculation Feifei Tian
[QE-users] "a" "b" values in "xanes.save" show "NaN" in xspectra calculation Feifei Tian
[QE-users] [PROVENANCE INTERNET] Issue with Fermi energies during a nscf calculation withSOC Paolo Giannozzi
[QE-users] Regarding phonon calculation error Satyasiban Dash ph19d005
[QE-users] Relaxation of W2N Error Rutika Savaliya
[QE-users] Relaxation of W2N Error Paolo Giannozzi
[QE-users] Relaxation of W2N Error Rutika Savaliya
[QE-users] Relaxation of W2N Error Pietro Davide Delugas
[QE-users] Doubts on phonon calculations under pressures Jibiao Li
[QE-users] Doubts on phonon calculations under pressures Jibiao Li
[QE-users] Doubts on phonon calculations under pressures Stefano Baroni
[QE-users] A quick question about vc-relax for 2dxz Dr. K. C. Bhamu
[QE-users] Regarding phonon calculation error Paolo Giannozzi
[QE-users] How to extract the px, py, pz, dz2, ....contributions with SOC from projdos out Elio Physics
[QE-users] Regarding phonon calculation error Satyasiban Dash ph19d005
[QE-users] neb - first_last_opt Aleksandra Oranskaia
[QE-users] neb - first_last_opt Lorenzo Paulatto
[QE-users] How to extract the px, py, pz, dz2, ....contributions with SOC from projdos out Thomas Brumme
[QE-users] How to extract the px, py, pz, dz2, ....contributions with SOC from projdos out Elio Physics
[QE-users] How to extract the px, py, pz, dz2, ....contributions with SOC from projdos out Pietro Davide Delugas
[QE-users] How to extract the px, py, pz, dz2, ....contributions with SOC from projdos out Pietro Davide Delugas
[QE-users] How to extract the px, py, pz, dz2, ....contributions with SOC from projdos out Elio Physics
[QE-users] [QE-GPU] Performance of the NGC Container Jonathan D. Halverson
[QE-users] [QE-GPU] Performance of the NGC Container Paolo Giannozzi
[QE-users] Interpolation for 2D phonons results in one imaginary branch near Gamma Thomas Brumme
[QE-users] Interpolation for 2D phonons results in one imaginary branch near Gamma Stefano Baroni
[QE-users] How to extract the px, py, pz, dz2, ....contributions with SOC from projdos out Elio Physics
[QE-users] order of the quantum number mj in the pDOS output Elio Physics
[QE-users] order of the quantum number mj in the pDOS output Thomas Brumme
[QE-users] order of the quantum number mj in the pDOS output Elio Physics
[QE-users] (no subject) khouini_f at znu.ac.ir
[QE-users] (no subject) khouini_f at znu.ac.ir
[QE-users] How can I make a Supercell? khouini_f at znu.ac.ir
[QE-users] How can I make a Supercell? Lorenzo Paulatto
[QE-users] How can I make a Supercell? Fabio Costa
[QE-users] unrecognized dft in phonon calculations Jibiao Li
[QE-users] unrecognized dft in phonon calculations Fabrizio Ferrari
[QE-users] unrecognized dft in phonon calculations Lorenzo Paulatto
[QE-users] Interpolation for 2D phonons results in one imaginary branch near Gamma Thomas Brumme
[QE-users] Interpolation for 2D phonons results in one imaginary branch near Gamma Vahid Askarpour
[QE-users] Interpolation for 2D phonons results in one imaginary branch near Gamma Thomas Brumme
[QE-users] Error in routine phq_readin Mauro Sgroi
[QE-users] Error in routine phq_readin Lorenzo Paulatto
[QE-users] Error in routine phq_readin Mauro Sgroi
[QE-users] MD in pw.x LEUNG Clarence
[QE-users] Error received when applying non-hydrostatic pressure at vc-relax Arif Emre Yarimbiyik
[QE-users] Bilayer graphene scf input file Henna Malakar
[QE-users] Error received when applying non-hydrostatic pressure at vc-relax mkondrin
[QE-users] Ionic Polarization calculation in Quantum Espresso Paul, Tanmoy Kumar
[QE-users] [QE-GPU] compilation with SDK 21.5 and CUDA 11.4 Marcelo Falcão de Oliveira
[QE-users] [QE-GPU] compilation with SDK 21.5 and CUDA 11.4 Paolo Giannozzi
[QE-users] [QE-GPU] Performance of the NGC Container Louis Stuber
[QE-users] Polarizability Calculations of water adsorbed on a metal surface Jibiao Li
[QE-users] refractive index using epsilon mehrdad zamzamian
[QE-users] QE6.6 installation LEUNG Clarence
[QE-users] Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5 errors Hong Tang
[QE-users] Thermal decomposition temperature using QE 鲍路瑶
[QE-users] Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5 errors Fabrizio Ferrari
[QE-users] f-orbital of Rare-Earth elements in USPP SYED ZAIN MEHMOOD
[QE-users] Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5 errors tanghong992 at outlook.com
[QE-users] Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5 errors Fabrizio Ferrari
[QE-users] Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5 errors tanghong992 at outlook.com
[QE-users] f-orbital of Rare-Earth elements in USPP Paolo Giannozzi
[QE-users] Inconsistency in electronic band structure of GeP3 monolayer Marcelo Albuquerque
[QE-users] Inconsistency in electronic band structure of GeP3 monolayer Giovanni Cantele
[QE-users] Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5 errors Hong Tang
[QE-users] Install QE 6.4.1 or QE 6.6 with Libxc.5.1.5 errors Paolo Giannozzi
[QE-users] QE6.6 installation Paolo Giannozzi
[QE-users] Quantum ESPRESSO v.6.8 Paolo Giannozzi
[QE-users] Inconsistency in electronic band structure of GeP3 monolayer Marcelo Albuquerque
[QE-users] Some_small_query_about_LaH3 poonamsharma
[QE-users] Some_small_query_about_LaH3 Matthew Marcus
[QE-users] QE6.8 and QE6.8 with Libxc.5.1.5 install and run errors Hong Tang
[QE-users] Some_small_query_about_LaH3 poonamsharma
[QE-users] QE6.8 and QE6.8 with Libxc.5.1.5 install and run errors Hong Tang
[QE-users] QE6.8 and QE6.8 with Libxc.5.1.5 install and run errors Hong Tang
[QE-users] epw erro size mismatch 王绍菲
[QE-users] QE6.8 and QE6.8 with Libxc.5.1.5 install and run errors Lorenzo Paulatto
[QE-users] QE6.8 and QE6.8 with Libxc.5.1.5 install and run errors Paolo Giannozzi
[QE-users] Extract Ggrid after Gamma trick Antoine Jay
[QE-users] Regarding local dos Satyasiban Dash ph19d005
[QE-users] [QE-GPU] Performance of the NGC Container Jonathan D. Halverson
[QE-users] Small query about magnetization poonamsharma
[QE-users] Error while performing hybrid calculations Elio Physics
[QE-users] Extract Ggrid after Gamma trick Paolo Giannozzi
[QE-users] Regarding Stm image Satyasiban Dash ph19d005
[QE-users] Regarding Stm image Paolo Giannozzi
[QE-users] Regarding Stm image pboulet
[QE-users] Regarding Stm image Satyasiban Dash ph19d005
[QE-users] Regarding Stm image Paolo Giannozzi
[QE-users] When use QHA, an error 'equivalent atomic symbols are not found' happens 路洪艳
[QE-users] When use QHA, an error 'equivalent atomic symbols are not found' happens Paolo Giannozzi
[QE-users] Doubt regarding the band gap calculation of graphene using HSE06 UPASANA NATH
[QE-users] Save charge density, not wavefunctions. Fabio Ferreira
[QE-users] CNT band structure ALVANH ALEM PIDO
[QE-users] QE 6.8 compilation Mohammad Moaddeli
[QE-users] CNT band structure Kazume NISHIDATE
[QE-users] CNT band structure Lorenzo Paulatto
[QE-users] Pseudopotentials error: not a valid URI Vedant Sachin Bang
[QE-users] [Webinar] Cathode Design Principles for Alkali-Ion Batteries Minkyu Park
[QE-users] Pseudopotentials error: not a valid URI Lorenzo Paulatto
[QE-users] Pseudopotentials error: not a valid URI Paolo Giannozzi
[QE-users] QE 6.8 compilation Paolo Giannozzi
[QE-users] GRID parallel electron phonon coupling Georg Eickerling
[QE-users] Regarding smearing Satyasiban Dash ph19d005
[QE-users] Regarding smearing Lorenzo Paulatto
[QE-users] Problem in SOC + magnetic calculations MEGHA GOYAL
[QE-users] Errors in opening Na and K tags in PSlibrary Jibiao Li
[QE-users] Atomic velocities units valeria arteaga muñiz
[QE-users] Errors in opening Na and K tags in PSlibrary Paolo Giannozzi
[QE-users] Atomic velocities units Paolo Giannozzi
[QE-users] Errors in opening Na and K tags in PSlibrary Jibiao Li
[QE-users] Errors in opening Na and K tags in PSlibrary Lorenzo Paulatto
[QE-users] Problem in SOC + magnetic calculations Lorenzo Paulatto
[QE-users] Errors in opening Na and K tags in PSlibrary Paolo Giannozzi
[QE-users] Errors in opening Na and K tags in PSlibrary Stefano Baroni
[QE-users] incompatible nr1x or nr2x error of charge density differences calculations Jibiao Li
[QE-users] incompatible nr1x or nr2x error of charge density differences calculations Paolo Giannozzi
[QE-users] Atomic velocities units valeria arteaga muñiz
[QE-users] Atomic velocities units Lorenzo Paulatto
[QE-users] Atomic velocities units valeria arteaga muñiz
[QE-users] Electron-phonon with Hubbard U is not supported 526587466
[QE-users] Electron-phonon with Hubbard U is not supported Iurii TIMROV
[QE-users] Electron-phonon with Hubbard U is not supported Iurii TIMROV
[QE-users] HP with tetrahedra is not supported 526587466
[QE-users] HP with tetrahedra is not supported Iurii TIMROV
[QE-users] Atomic velocities units Lorenzo Paulatto
[QE-users] compilation errors @ QE 6.8 version venky ch
[QE-users] pw.x Error for QE6.4 venky ch
[QE-users] plot 1D charge density in quantum espresso sara akbari
[QE-users] compilation errors @ QE 6.8 version venky ch
[QE-users] pw.x Error for QE6.4 venky ch
[QE-users] Electron-phonon with Hubbard U is not supported W2AGZ
[QE-users] compilation errors @ QE 6.8 version Paolo Giannozzi
[QE-users] compilation errors @ QE 6.8 version venky ch
[QE-users] regarding scan functional Soumendra Kumar Das
[QE-users] regarding scan functional Claudio A. Perottoni

Last message date: Sat Jul 31 13:48:57 CEST 2021
Archived on: Sat Jul 31 13:48:22 CEST 2021

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