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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
match ; Eigenvalue 1 ; GREPFIELD(static/info, ' 1 --', 3) ; -0.248426
match ; Eigenvalue 2 ; GREPFIELD(static/info, ' 2 --', 3) ; -0.056939
match ; Eigenvalue 3 ; GREPFIELD(static/info, ' 3 --', 3) ; -0.048611
match ; Eigenvalue 4 ; GREPFIELD(static/info, ' 4 --', 3) ; -0.039065
match ; Total energy ; GREPFIELD(static/info, 'Total =', 3) ; -1.91221164
match ; Free energy ; GREPFIELD(static/info, 'Free =', 3) ; -1.93735493
match ; Fermi energy ; GREPFIELD(static/info, 'Fermi energy =', 4); -0.066015
Input: 03-magnetic.02-td-unpolarized.inp
match ; Energy [step 1] ; LINEFIELD(td.general/energy, -21, 3) ; -1.912211890243e+00
match ; Energy [step 5] ; LINEFIELD(td.general/energy, -16, 3) ; -1.897585403351e+00
match ; Energy [step 10] ; LINEFIELD(td.general/energy, -11, 3) ; -1.897585391868e+00
match ; Energy [step 15] ; LINEFIELD(td.general/energy, -6, 3) ; -1.897585897744e+00
match ; Energy [step 20] ; LINEFIELD(td.general/energy, -1, 3) ; -1.897585936817e+00
Input: 03-magnetic.03-gs-polarized.inp
match ; SCF convergence ; GREPCOUNT(static/info, 'SCF converged') ; 1
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) ; -1.92627692
match ; Free energy ; GREPFIELD(static/info, 'Free =', 3) ; -1.94485861
match ; Fermi energy ; GREPFIELD(static/info, 'Fermi energy =', 4); -0.076598
Input: 03-magnetic.04-td-polarized.inp
match ; Energy [step 1] ; LINEFIELD(td.general/energy, -21, 3) ; -1.926276211519e+00
match ; Energy [step 5] ; LINEFIELD(td.general/energy, -16, 3) ; -1.911651562369e+00
match ; Energy [step 10] ; LINEFIELD(td.general/energy, -11, 3) ; -1.911651557924e+00
match ; Energy [step 15] ; LINEFIELD(td.general/energy, -6, 3) ; -1.911652069280e+00
match ; Energy [step 20] ; LINEFIELD(td.general/energy, -1, 3) ; -1.911652106716e+00
Input: 03-magnetic.05-gs-spinors.inp
match ; SCF convergence ; GREPCOUNT(static/info, 'SCF converged') ; 1
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 ; Eigenvalue 5 ; GREPFIELD(static/info, ' 4 --', 3) ; -0.068886
match ; Total energy ; GREPFIELD(static/info, 'Total =', 3) ; -1.92715542
match ; Free energy ; GREPFIELD(static/info, 'Free =', 3) ; -1.94465527
match ; Fermi energy ; GREPFIELD(static/info, 'Fermi energy =', 4); -0.076684
Input: 03-magnetic.06-td-spinors.inp
match ; Energy [step 1] ; LINEFIELD(td.general/energy, -21, 3) ; -1.927155329551e+00
match ; Energy [step 5] ; LINEFIELD(td.general/energy, -16, 3) ; -1.912530841625e+00
match ; Energy [step 10] ; LINEFIELD(td.general/energy, -11, 3) ; -1.912530837840e+00
match ; Energy [step 15] ; LINEFIELD(td.general/energy, -6, 3) ; -1.912531349756e+00
match ; Energy [step 20] ; LINEFIELD(td.general/energy, -1, 3) ; -1.912531387073e+00