lda_u/07-noncollinear.test passes even if the SCF is not converged
This test takes very long and it doesn't converge, but still passes. This is the output in my system:
** Warning:
** SCF *not* converged after 200 iterations.
Elapsed time: 615.0 s
Execution : [ OK ]
Total k-points : [ OK ] (Calculated value = 4)
Reduced k-points : [ OK ] (Calculated value = 2)
Total energy : [ OK ] (Calculated value = -246.87070559)
Ion-ion energy : [ OK ] (Calculated value = -177.00987193)
Eigenvalues sum : [ OK ] (Calculated value = -32.98368782)
Hartree energy : [ OK ] (Calculated value = 45.37598990)
Exchange energy : [ OK ] (Calculated value = -27.44988379)
Correlation energy : [ OK ] (Calculated value = -2.05101957)
Kinetic energy : [ OK ] (Calculated value = 122.09672305)
External energy : [ OK ] (Calculated value = -208.05096505)
Hubbard energy : [ OK ] (Calculated value = 0.22541034)
Total Magnetic Moment x : [ OK ] (Calculated value = -0.000000)
Total Magnetic Moment y : [ OK ] (Calculated value = -0.000000)
Total Magnetic Moment z : [ OK ] (Calculated value = -0.000000)
Local Magnetic Moment (Ni1) : [ OK ] (Calculated value = 3.240118)
Local Magnetic Moment (Ni2) : [ OK ] (Calculated value = -3.240074)
Local Magnetic Moment (O1) : [ OK ] (Calculated value = -0.000029)
Local Magnetic Moment (O2) : [ OK ] (Calculated value = -0.000029)
k-point 1 (x) : [ OK ] (Calculated value = 0.000000)
k-point 1 (y) : [ OK ] (Calculated value = 0.000000)
k-point 1 (z) : [ OK ] (Calculated value = 0.000000)
Eigenvalue 1 : [ OK ] (Calculated value = -3.071938)
Eigenvalue 8 : [ OK ] (Calculated value = -2.919229)
Eigenvalue 16 : [ OK ] (Calculated value = -0.449401)
Eigenvalue 17 : [ OK ] (Calculated value = -0.170572)
Occupation Ni2 up-down 3d4 : [ OK ] (Calculated value = -0.05332972)
Occupation Ni2 up-down 3d5 : [ OK ] (Calculated value = -0.37622104)
Edited by Xavier Andrade