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# -*- coding: utf-8 mode: shell-script -*-
Test : Static magnetic field
Program : octopus
TestGroups : long-run, finite_systems_3d
Enabled : Yes
Input: 03-magnetic.01-gs-unpolarized.inp
match ; SCF convergence ; GREPCOUNT(static/info, 'SCF converged') ; 1.0
match ; Eigenvalue 1 ; GREPFIELD(static/info, ' 1 --', 3) ; -0.248425
Precision: 5.50e-07
match ; Eigenvalue 2 ; GREPFIELD(static/info, ' 2 --', 3) ; -0.0569385
Precision: 8.25e-08
match ; Eigenvalue 3 ; GREPFIELD(static/info, ' 3 --', 3) ; -0.04861
match ; Eigenvalue 4 ; GREPFIELD(static/info, ' 4 --', 3) ; -0.039065
match ; Total energy ; GREPFIELD(static/info, 'Total =', 3) ; -1.912211975
Precision: 7.70e-08
match ; Free energy ; GREPFIELD(static/info, 'Free =', 3) ; -1.93735519
match ; Fermi energy ; GREPFIELD(static/info, 'Fermi energy =', 4) ; -0.066015
Input: 03-magnetic.02-td-unpolarized.inp
Precision: 8.19e-11
match ; Energy [step 1] ; LINEFIELD(td.general/energy, -21, 3) ; -1.9122118917405
Precision: 3.37e-10
match ; Energy [step 5] ; LINEFIELD(td.general/energy, -16, 3) ; -1.8975681556869999
Precision: 3.37e-10
match ; Energy [step 10] ; LINEFIELD(td.general/energy, -11, 3) ; -1.8975681356890002
Precision: 3.37e-10
match ; Energy [step 15] ; LINEFIELD(td.general/energy, -6, 3) ; -1.8975686324
Precision: 3.37e-10
match ; Energy [step 20] ; LINEFIELD(td.general/energy, -1, 3) ; -1.8975686638620002
Input: 03-magnetic.03-gs-polarized.inp
match ; SCF convergence ; GREPCOUNT(static/info, 'SCF converged') ; 1
Precision: 8.25e-08
match ; Eigenvalue 1 up ; GREPFIELD(static/info, ' 1 up', 3) ; -0.223895
match ; Eigenvalue 2 up ; GREPFIELD(static/info, ' 2 up', 3) ; -0.033319
match ; Eigenvalue 3 up ; GREPFIELD(static/info, ' 3 up', 3) ; -0.025279
match ; Eigenvalue 4 up ; GREPFIELD(static/info, ' 4 up', 3) ; -0.015446
match ; Eigenvalue 1 dn ; GREPFIELD(static/info, ' 1 dn', 3) ; -0.269533
match ; Eigenvalue 2 dn ; GREPFIELD(static/info, ' 2 dn', 3) ; -0.077346
match ; Eigenvalue 3 dn ; GREPFIELD(static/info, ' 3 dn', 3) ; -0.068474
match ; Eigenvalue 4 dn ; GREPFIELD(static/info, ' 4 dn', 3) ; -0.059473
match ; Total energy ; GREPFIELD(static/info, 'Total =', 3) ; -1.926276225
match ; Free energy ; GREPFIELD(static/info, 'Free =', 3) ; -1.944858295
match ; Fermi energy ; GREPFIELD(static/info, 'Fermi energy =', 4) ; -0.076598
Input: 03-magnetic.04-td-polarized.inp
Precision: 1.8e-10
match ; Energy [step 1] ; LINEFIELD(td.general/energy, -21, 3) ; -1.9262762036195
Precision: 9.6e-10
match ; Energy [step 5] ; LINEFIELD(td.general/energy, -16, 3) ; -1.911634710849
match ; Energy [step 10] ; LINEFIELD(td.general/energy, -11, 3) ; -1.9116346978395
match ; Energy [step 15] ; LINEFIELD(td.general/energy, -6, 3) ; -1.911635199899
match ; Energy [step 20] ; LINEFIELD(td.general/energy, -1, 3) ; -1.9116352296944998
Input: 03-magnetic.05-gs-spinors.inp
match ; SCF convergence ; GREPCOUNT(static/info, 'SCF converged') ; 1
Precision: 2.20e-08
match ; Eigenvalue 1 ; GREPFIELD(static/info, ' 1 --', 3) ; -0.270007
match ; Eigenvalue 2 ; GREPFIELD(static/info, ' 2 --', 3) ; -0.223101
match ; Eigenvalue 3 ; GREPFIELD(static/info, ' 3 --', 3) ; -0.077802
match ; Eigenvalue 4 ; GREPFIELD(static/info, ' 4 --', 3) ; -0.068886
match ; Total energy ; GREPFIELD(static/info, 'Total =', 3) ; -1.92715532
match ; Free energy ; GREPFIELD(static/info, 'Free =', 3) ; -1.94465509
match ; Fermi energy ; GREPFIELD(static/info, 'Fermi energy =', 4) ; -0.076684
Input: 03-magnetic.06-td-spinors.inp
Precision: 6.2e-10
match ; Energy [step 1] ; LINEFIELD(td.general/energy, -21, 3) ; -1.927155330019
match ; Energy [step 5] ; LINEFIELD(td.general/energy, -16, 3) ; -1.912514037583
match ; Energy [step 10] ; LINEFIELD(td.general/energy, -11, 3) ; -1.9125140252269999
match ; Energy [step 15] ; LINEFIELD(td.general/energy, -6, 3) ; -1.9125145278335
match ; Energy [step 20] ; LINEFIELD(td.general/energy, -1, 3) ; -1.9125145575045