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Quantum-Dynamics-Hub · Nov 17, 2021 · 2a15e10 · 2a15e10
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diff --git a/tests/test_qe/test_1_no_soc/o b/tests/test_qe/test_1_no_soc/o
diff --git a/tests/test_qe/test_1_no_soc/x.exp.out b/tests/test_qe/test_1_no_soc/x.exp.out
diff --git a/tests/test_qe/test_1_no_soc/x.export/grid.1 b/tests/test_qe/test_1_no_soc/x.export/grid.1
diff --git a/tests/test_qe/test_1_no_soc/x.export/grid.2 b/tests/test_qe/test_1_no_soc/x.export/grid.2
diff --git a/tests/test_qe/test_1_no_soc/x.export/index.xml b/tests/test_qe/test_1_no_soc/x.export/index.xml
diff --git a/tests/test_qe/test_1_no_soc/x.export/mgrid b/tests/test_qe/test_1_no_soc/x.export/mgrid
diff --git a/tests/test_qe/test_1_no_soc/x.export/wfc.1 b/tests/test_qe/test_1_no_soc/x.export/wfc.1
diff --git a/tests/test_qe/test_1_no_soc/x.export/wfc.2 b/tests/test_qe/test_1_no_soc/x.export/wfc.2
diff --git a/tests/test_qe/test_1_no_soc/x.paw b/tests/test_qe/test_1_no_soc/x.paw
diff --git a/tests/test_qe/test_1_no_soc/x.save/C.pbe-n-kjpaw_psl.0.1.UPF b/tests/test_qe/test_1_no_soc/x.save/C.pbe-n-kjpaw_psl.0.1.UPF
diff --git a/tests/test_qe/test_1_no_soc/x.save/H.pbe-kjpaw_psl.0.1.UPF b/tests/test_qe/test_1_no_soc/x.save/H.pbe-kjpaw_psl.0.1.UPF
diff --git a/tests/test_qe/test_1_no_soc/x.save/K00001/eigenval1.xml b/tests/test_qe/test_1_no_soc/x.save/K00001/eigenval1.xml
diff --git a/tests/test_qe/test_1_no_soc/x.save/K00001/eigenval2.xml b/tests/test_qe/test_1_no_soc/x.save/K00001/eigenval2.xml
diff --git a/tests/test_qe/test_1_no_soc/x.save/charge-density.dat b/tests/test_qe/test_1_no_soc/x.save/charge-density.dat
diff --git a/tests/test_qe/test_1_no_soc/x.save/data-file.xml b/tests/test_qe/test_1_no_soc/x.save/data-file.xml
diff --git a/tests/test_qe/test_1_no_soc/x.save/spin-polarization.dat b/tests/test_qe/test_1_no_soc/x.save/spin-polarization.dat
diff --git a/tests/test_qe/test_1_no_soc/x.scf.out b/tests/test_qe/test_1_no_soc/x.scf.out
diff --git a/tests/test_qe/test_1_no_soc/x.wfc b/tests/test_qe/test_1_no_soc/x.wfc
diff --git a/tests/test_qe/test_2_soc/x.exp.out b/tests/test_qe/test_2_soc/x.exp.out
diff --git a/tests/test_qe/test_2_soc/x.export/grid.1 b/tests/test_qe/test_2_soc/x.export/grid.1
diff --git a/tests/test_qe/test_2_soc/x.export/index.xml b/tests/test_qe/test_2_soc/x.export/index.xml
diff --git a/tests/test_qe/test_2_soc/x.export/mgrid b/tests/test_qe/test_2_soc/x.export/mgrid
diff --git a/tests/test_qe/test_2_soc/x.export/wfc.1 b/tests/test_qe/test_2_soc/x.export/wfc.1
diff --git a/tests/test_qe/test_2_soc/x.paw b/tests/test_qe/test_2_soc/x.paw
diff --git a/tests/test_qe/test_2_soc/x.save/C.rel-pbe-n-kjpaw_psl.0.1.UPF b/tests/test_qe/test_2_soc/x.save/C.rel-pbe-n-kjpaw_psl.0.1.UPF
diff --git a/tests/test_qe/test_2_soc/x.save/H.rel-pbe-kjpaw_psl.0.1.UPF b/tests/test_qe/test_2_soc/x.save/H.rel-pbe-kjpaw_psl.0.1.UPF
diff --git a/tests/test_qe/test_2_soc/x.save/K00001/eigenval.xml b/tests/test_qe/test_2_soc/x.save/K00001/eigenval.xml
diff --git a/tests/test_qe/test_2_soc/x.save/K00001/evc1.dat b/tests/test_qe/test_2_soc/x.save/K00001/evc1.dat
diff --git a/tests/test_qe/test_2_soc/x.save/K00001/evc2.dat b/tests/test_qe/test_2_soc/x.save/K00001/evc2.dat
diff --git a/tests/test_qe/test_2_soc/x.save/K00001/gkvectors.dat b/tests/test_qe/test_2_soc/x.save/K00001/gkvectors.dat
diff --git a/tests/test_qe/test_2_soc/x.save/charge-density.dat b/tests/test_qe/test_2_soc/x.save/charge-density.dat
diff --git a/tests/test_qe/test_2_soc/x.save/data-file.xml b/tests/test_qe/test_2_soc/x.save/data-file.xml
diff --git a/tests/test_qe/test_2_soc/x.save/gvectors.dat b/tests/test_qe/test_2_soc/x.save/gvectors.dat
diff --git a/tests/test_qe/test_2_soc/x.scf.out b/tests/test_qe/test_2_soc/x.scf.out
diff --git a/tests/test_qe/test_2_soc/x.wfc b/tests/test_qe/test_2_soc/x.wfc
diff --git a/tests/test_qe/test_3_k_points/o b/tests/test_qe/test_3_k_points/o
diff --git a/tests/test_qe/test_3_k_points/x.exp.out b/tests/test_qe/test_3_k_points/x.exp.out
diff --git a/tests/test_qe/test_3_k_points/x.export/grid.1 b/tests/test_qe/test_3_k_points/x.export/grid.1
diff --git a/tests/test_qe/test_3_k_points/x.export/grid.2 b/tests/test_qe/test_3_k_points/x.export/grid.2
diff --git a/tests/test_qe/test_3_k_points/x.export/grid.3 b/tests/test_qe/test_3_k_points/x.export/grid.3
diff --git a/tests/test_qe/test_3_k_points/x.export/index.xml b/tests/test_qe/test_3_k_points/x.export/index.xml
diff --git a/tests/test_qe/test_3_k_points/x.export/mgrid b/tests/test_qe/test_3_k_points/x.export/mgrid
diff --git a/tests/test_qe/test_3_k_points/x.export/wfc.1 b/tests/test_qe/test_3_k_points/x.export/wfc.1
diff --git a/tests/test_qe/test_3_k_points/x.export/wfc.2 b/tests/test_qe/test_3_k_points/x.export/wfc.2
diff --git a/tests/test_qe/test_3_k_points/x.export/wfc.3 b/tests/test_qe/test_3_k_points/x.export/wfc.3
diff --git a/tests/test_qe/test_3_k_points/x.paw b/tests/test_qe/test_3_k_points/x.paw
diff --git a/tests/test_qe/test_3_k_points/x.save/C.pbe-n-kjpaw_psl.0.1.UPF b/tests/test_qe/test_3_k_points/x.save/C.pbe-n-kjpaw_psl.0.1.UPF
diff --git a/tests/test_qe/test_3_k_points/x.save/H.pbe-kjpaw_psl.0.1.UPF b/tests/test_qe/test_3_k_points/x.save/H.pbe-kjpaw_psl.0.1.UPF
diff --git a/tests/test_qe/test_3_k_points/x.save/K00001/eigenval.xml b/tests/test_qe/test_3_k_points/x.save/K00001/eigenval.xml
diff --git a/tests/test_qe/test_3_k_points/x.save/K00002/eigenval.xml b/tests/test_qe/test_3_k_points/x.save/K00002/eigenval.xml
diff --git a/tests/test_qe/test_3_k_points/x.save/K00003/eigenval.xml b/tests/test_qe/test_3_k_points/x.save/K00003/eigenval.xml
diff --git a/tests/test_qe/test_3_k_points/x.save/charge-density.dat b/tests/test_qe/test_3_k_points/x.save/charge-density.dat
diff --git a/tests/test_qe/test_3_k_points/x.save/data-file.xml b/tests/test_qe/test_3_k_points/x.save/data-file.xml
diff --git a/tests/test_qe/test_3_k_points/x.scf.out b/tests/test_qe/test_3_k_points/x.scf.out
diff --git a/tests/test_qe/test_3_k_points/x.wfc b/tests/test_qe/test_3_k_points/x.wfc