sensitivity-analysis.zip
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__MACOSX
._sensitivity
176 Bytes
sensitivity
._AgF2_mpds_S1219456
176 Bytes
._BMo_mpds_S313403
176 Bytes
._BaB2
176 Bytes
._Be2B_mpds_S1815131
176 Bytes
._BeMo3_mpds_S451405
176 Bytes
._CrH_mpds_S1925177
176 Bytes
._HfSbRu_mpds_S1612211
176 Bytes
._IrS2_icsd_659260
176 Bytes
._Li2AlGe_mpds_S1710218
176 Bytes
._Li2AlGe_mpds_S1710218_new
176 Bytes
._LiAl2Ge_mpds_S1710219
176 Bytes
._MgB2_mpds_S1637289
176 Bytes
._Nb6Sn2_mpds_S378780
176 Bytes
._NbCoSb_mpds_S1612207
176 Bytes
._NbRu3C_icsd_77216
176 Bytes
._Nb_mpds_S1300517
176 Bytes
._PtO_mpds_S554388
176 Bytes
._PtO_mpds_S554388_new
176 Bytes
._ReW3_mpds_S529097
176 Bytes
._RhS2_mpds_S458288
176 Bytes
._RhSe_mpds_S526947
176 Bytes
._TaB2Mo2_icsd_614842
176 Bytes
._TaB2Mo2_icsd_614842_new
176 Bytes
._TaCoSb_mpds_S1612208
176 Bytes
._TaRu3C_icsd_77392
176 Bytes
._TaS_mpds_S551347
176 Bytes
._TaSe2_mpds_S1815445
176 Bytes
._TeAs_mpds_S1605628
176 Bytes
._Ti2Ga_mpds_S1240874
176 Bytes
._Ti3SnH_mpds_S1120272
176 Bytes
._Ti3TlN_mpds_S540352
176 Bytes
._TiSbRu_mpds_S1612209
176 Bytes
._VC_mpds_S261186
176 Bytes
._W2N3_mpds_S1605022
176 Bytes
._YB2Ir3_mpds_S300212
176 Bytes
._YB2Ir3_mpds_S300212_old
176 Bytes
._YCCl_mpds_S1708524
176 Bytes
._YCI_mpds_S1708517
176 Bytes
._YC_mpds_S1210913
176 Bytes
._Zr2Al_mpds_S379268
176 Bytes
._Zr3Sn_mpds_S261544
176 Bytes
._ZrRuSb
176 Bytes
._ZrS_mpds_S527272
176 Bytes
AgF2_mpds_S1219456
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
BMo_mpds_S313403
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
BaB2
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
Be2B_mpds_S1815131
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
BeMo3_mpds_S451405
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
CrH_mpds_S1925177
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
HfSbRu_mpds_S1612211
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
IrS2_icsd_659260
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
Li2AlGe_mpds_S1710218
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
Li2AlGe_mpds_S1710218_new
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
LiAl2Ge_mpds_S1710219
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
MgB2_mpds_S1637289
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
Nb6Sn2_mpds_S378780
._doping
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
NbCoSb_mpds_S1612207
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
NbRu3C_icsd_77216
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
50
._aiida.imag_iso_004.00
176 Bytes
._aiida.imag_iso_006.67
176 Bytes
._aiida.imag_iso_009.33
176 Bytes
._aiida.imag_iso_012.00
176 Bytes
._aiida.imag_iso_014.67
176 Bytes
._aiida.imag_iso_017.33
176 Bytes
._aiida.imag_iso_020.00
176 Bytes
._aiida.imag_iso_gap0
176 Bytes
._iso.in
176 Bytes
._iso.out
176 Bytes
n25
._aiida.imag_iso_004.00
176 Bytes
._aiida.imag_iso_006.67
176 Bytes
._aiida.imag_iso_009.33
176 Bytes
._aiida.imag_iso_012.00
176 Bytes
._aiida.imag_iso_014.67
176 Bytes
._aiida.imag_iso_017.33
176 Bytes
._aiida.imag_iso_020.00
176 Bytes
._aiida.imag_iso_gap0
176 Bytes
._iso.in
176 Bytes
._iso.out
176 Bytes
n50
._aiida.imag_iso_004.00
176 Bytes
._aiida.imag_iso_009.33
176 Bytes
._aiida.imag_iso_012.00
176 Bytes
._aiida.imag_iso_014.67
176 Bytes
._aiida.imag_iso_020.00
176 Bytes
._iso.in
176 Bytes
._iso.out
176 Bytes
Nb_mpds_S1300517
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
PtO_mpds_S554388
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.pdoping.in
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
PtO_mpds_S554388_new
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
ReW3_mpds_S529097
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
RhS2_mpds_S458288
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
RhSe_mpds_S526947
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
TaB2Mo2_icsd_614842
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
TaB2Mo2_icsd_614842_new
._doping
176 Bytes
._efshifting
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
TaCoSb_mpds_S1612208
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
TaRu3C_icsd_77392
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
TaS_mpds_S551347
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
TaSe2_mpds_S1815445
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
TeAs_mpds_S1605628
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
Ti2Ga_mpds_S1240874
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
Ti3SnH_mpds_S1120272
._doping
176 Bytes
._efshifting
176 Bytes
doping
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176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
Ti3TlN_mpds_S540352
._doping
176 Bytes
._efshifting
176 Bytes
doping
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176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
TiSbRu_mpds_S1612209
._doping
176 Bytes
._efshifting
176 Bytes
doping
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176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
VC_mpds_S261186
._doping
176 Bytes
._efshifting
176 Bytes
doping
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176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
W2N3_mpds_S1605022
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
YB2Ir3_mpds_S300212
._doping
176 Bytes
YB2Ir3_mpds_S300212_old
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
YCCl_mpds_S1708524
._doping
176 Bytes
._efshifting
176 Bytes
doping
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176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
YCI_mpds_S1708517
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
YC_mpds_S1210913
._doping
176 Bytes
._efshifting
176 Bytes
doping
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176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
Zr2Al_mpds_S379268
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
Zr3Sn_mpds_S261544
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._25
176 Bytes
._50
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
ZrRuSb
._doping
176 Bytes
ZrS_mpds_S527272
._doping
176 Bytes
._efshifting
176 Bytes
doping
._scf.edoping.in
176 Bytes
._scf.edoping.out
176 Bytes
._scf.pdoping.in
176 Bytes
._scf.pdoping.out
176 Bytes
efshifting
._100
176 Bytes
._25
176 Bytes
._50
176 Bytes
._n100
176 Bytes
._n25
176 Bytes
._n50
176 Bytes
sensitivity
AgF2_mpds_S1219456
doping
scf.edoping.in
1.3 kB
scf.edoping.out
342.2 kB
scf.pdoping.in
1.3 kB
scf.pdoping.out
342.2 kB
efshifting
25
50
n25
n50
BMo_mpds_S313403
doping
scf.edoping.in
1.2 kB
scf.edoping.out
353.0 kB
scf.pdoping.in
1.2 kB
scf.pdoping.out
353.0 kB
efshifting
100
25
50
n100
n25
n50
BaB2
doping
scf.edoping.in
937 Bytes
scf.edoping.out
79.1 kB
scf.pdoping.in
937 Bytes
scf.pdoping.out
79.1 kB
efshifting
25
50
n25
n50
Be2B_mpds_S1815131
doping
scf.edoping.in
1.1 kB
scf.edoping.out
102.1 kB
scf.pdoping.in
1.1 kB
scf.pdoping.out
100.1 kB
efshifting
100
25
50
n100
n25
n50
BeMo3_mpds_S451405
doping
scf.edoping.in
1.4 kB
scf.edoping.out
92.1 kB
scf.pdoping.in
1.4 kB
scf.pdoping.out
92.1 kB
efshifting
25
50
n25
n50
CrH_mpds_S1925177
doping
scf.edoping.in
1.0 kB
scf.edoping.out
158.9 kB
scf.pdoping.in
1.0 kB
scf.pdoping.out
154.9 kB
efshifting
25
50
n25
n50
HfSbRu_mpds_S1612211
doping
scf.edoping.in
1.1 kB
scf.edoping.out
85.6 kB
scf.pdoping.in
1.1 kB
scf.pdoping.out
86.1 kB
efshifting
25
50
n25
n50
IrS2_icsd_659260
doping
scf.edoping.in
1.7 kB
scf.edoping.out
109.0 kB
scf.pdoping.in
1.7 kB
scf.pdoping.out
108.2 kB
efshifting
25
50
n25
n50
Li2AlGe_mpds_S1710218
doping
scf.edoping.in
1.2 kB
scf.edoping.out
70.4 kB
scf.pdoping.in
1.2 kB
scf.pdoping.out
69.7 kB
efshifting
100
25
50
n100
n25
n50
Li2AlGe_mpds_S1710218_new
doping
scf.edoping.in
1.2 kB
scf.edoping.out
492.6 kB
scf.pdoping.in
1.2 kB
scf.pdoping.out
476.9 kB
efshifting
25
50
n25
n50
LiAl2Ge_mpds_S1710219
doping
scf.edoping.in
1.2 kB
scf.edoping.out
493.1 kB
scf.pdoping.in
1.2 kB
scf.pdoping.out
477.0 kB
efshifting
25
50
n25
n50
MgB2_mpds_S1637289
doping
scf.edoping.in
1.1 kB
scf.edoping.out
129.0 kB
scf.pdoping.in
1.1 kB
scf.pdoping.out
129.6 kB
efshifting
100
25
50
n100
n25
n50
Nb6Sn2_mpds_S378780
doping
scf.edoping.in
1.4 kB
scf.edoping.out
98.1 kB
scf.pdoping.in
1.4 kB
scf.pdoping.out
97.4 kB
NbCoSb_mpds_S1612207
doping
scf.edoping.in
1.1 kB
scf.edoping.out
97.1 kB
scf.pdoping.in
1.1 kB
scf.pdoping.out
97.7 kB
efshifting
25
50
n25
n50
NbRu3C_icsd_77216
doping
scf.edoping.in
1.3 kB
scf.edoping.out
100.0 kB
scf.pdoping.in
1.3 kB
scf.pdoping.out
98.8 kB
efshifting
25
50
aiida.imag_iso_004.00
14.2 kB
aiida.imag_iso_006.67
8.5 kB
aiida.imag_iso_009.33
6.1 kB
aiida.imag_iso_012.00
4.8 kB
aiida.imag_iso_014.67
3.9 kB
aiida.imag_iso_017.33
3.3 kB
aiida.imag_iso_020.00
2.9 kB
aiida.imag_iso_gap0
111 Bytes
iso.in
995 Bytes
iso.out
25.7 kB
n25
aiida.imag_iso_004.00
14.2 kB
aiida.imag_iso_006.67
8.5 kB
aiida.imag_iso_009.33
6.1 kB
aiida.imag_iso_012.00
4.8 kB
aiida.imag_iso_014.67
3.9 kB
aiida.imag_iso_017.33
3.3 kB
aiida.imag_iso_020.00
2.9 kB
aiida.imag_iso_gap0
112 Bytes
iso.in
995 Bytes
iso.out
22.8 kB
n50
aiida.imag_iso_004.00
14.2 kB
aiida.imag_iso_009.33
6.1 kB
aiida.imag_iso_012.00
4.8 kB
aiida.imag_iso_014.67
3.9 kB
aiida.imag_iso_017.33
3.3 kB
aiida.imag_iso_020.00
2.9 kB
iso.in
1.0 kB
iso.out
53.7 kB
Nb_mpds_S1300517
doping
scf.edoping.in
954 Bytes
scf.edoping.out
127.4 kB
scf.pdoping.in
953 Bytes
scf.pdoping.out
123.8 kB
efshifting
100
25
50
n100
n25
n50
PtO_mpds_S554388
doping
scf.edoping.in
1.2 kB
scf.pdoping.in
1.2 kB
efshifting
25
50
n25
n50
PtO_mpds_S554388_new
doping
scf.edoping.in
1.2 kB
scf.edoping.out
171.4 kB
scf.pdoping.in
1.2 kB
scf.pdoping.out
170.8 kB
efshifting
25
50
n25
n50
ReW3_mpds_S529097
doping
scf.edoping.in
1.4 kB
scf.edoping.out
102.1 kB
scf.pdoping.in
1.4 kB
scf.pdoping.out
102.7 kB
efshifting
100
25
50
n100
n25
n50
RhS2_mpds_S458288
doping
scf.edoping.in
1.7 kB
scf.edoping.out
109.4 kB
scf.pdoping.in
1.7 kB
scf.pdoping.out
109.8 kB
efshifting
25
50
n25
n50
RhSe_mpds_S526947
doping
scf.edoping.in
1.2 kB
scf.edoping.out
136.7 kB
scf.pdoping.in
1.2 kB
scf.pdoping.out
136.7 kB
efshifting
100
25
50
n100
n25
n50
TaB2Mo2_icsd_614842
doping
scf.edoping.in
1.6 kB
scf.edoping.out
138.1 kB
scf.pdoping.in
1.6 kB
scf.pdoping.out
138.2 kB
efshifting
25
50
n25
n50
TaB2Mo2_icsd_614842_new
doping
efshifting
25
50
n25
n50
TaCoSb_mpds_S1612208
doping
scf.edoping.in
1.1 kB
scf.edoping.out
97.8 kB
scf.pdoping.in
1.1 kB
scf.pdoping.out
97.8 kB
efshifting
25
50
n25
n50
TaRu3C_icsd_77392
doping
scf.edoping.in
1.3 kB
scf.edoping.out
99.5 kB
scf.pdoping.in
1.3 kB
scf.pdoping.out
100.7 kB
efshifting
25
50
n25
n50
TaS_mpds_S551347
doping
scf.edoping.in
1.0 kB
scf.edoping.out
120.5 kB
scf.pdoping.in
1.0 kB
scf.pdoping.out
117.7 kB
efshifting
100
25
50
n100
n25
n50
TaSe2_mpds_S1815445
doping
scf.edoping.in
1.3 kB
scf.edoping.out
94.8 kB
scf.pdoping.in
1.3 kB
scf.pdoping.out
96.0 kB
efshifting
25
50
n25
n50
TeAs_mpds_S1605628
doping
scf.edoping.in
1.0 kB
scf.edoping.out
91.4 kB
scf.pdoping.in
1.0 kB
scf.pdoping.out
89.2 kB
efshifting
100
25
50
n100
n25
n50
Ti2Ga_mpds_S1240874
doping
scf.edoping.in
1.3 kB
scf.edoping.out
120.9 kB
scf.pdoping.in
1.3 kB
scf.pdoping.out
120.9 kB
efshifting
25
50
n25
n50
Ti3SnH_mpds_S1120272
doping
scf.edoping.in
1.2 kB
scf.edoping.out
89.0 kB
scf.pdoping.in
1.2 kB
scf.pdoping.out
87.8 kB
efshifting
100
25
50
n100
n25
n50
Ti3TlN_mpds_S540352
doping
scf.edoping.in
1.3 kB
scf.edoping.out
92.7 kB
scf.pdoping.in
1.3 kB
scf.pdoping.out
93.4 kB
efshifting
25
50
n25
n50
TiSbRu_mpds_S1612209
doping
scf.edoping.in
1.1 kB
scf.edoping.out
86.1 kB
scf.pdoping.in
1.1 kB
scf.pdoping.out
84.8 kB
efshifting
25
50
n25
n50
VC_mpds_S261186
doping
scf.edoping.in
1.0 kB
scf.edoping.out
135.6 kB
scf.pdoping.in
1.0 kB
scf.pdoping.out
137.6 kB
efshifting
25
50
n25
n50
W2N3_mpds_S1605022
doping
scf.edoping.in
1.5 kB
scf.edoping.out
119.7 kB
scf.pdoping.in
1.5 kB
scf.pdoping.out
120.9 kB
efshifting
100
25
50
n100
n25
n50
YB2Ir3_mpds_S300212
doping
YB2Ir3_mpds_S300212_old
doping
scf.edoping.in
1.3 kB
scf.edoping.out
351.3 kB
scf.pdoping.in
1.3 kB
scf.pdoping.out
351.4 kB
efshifting
25
50
n25
n50
YCCl_mpds_S1708524
doping
scf.edoping.in
1.3 kB
scf.edoping.out
196.2 kB
scf.pdoping.in
1.3 kB
scf.pdoping.out
196.0 kB
efshifting
100
25
50
n100
n25
n50
YCI_mpds_S1708517
doping
scf.edoping.in
1.3 kB
scf.edoping.out
164.5 kB
scf.pdoping.in
1.3 kB
scf.pdoping.out
165.7 kB
efshifting
100
25
50
n100
n25
n50
YC_mpds_S1210913
doping
scf.edoping.in
1.0 kB
scf.edoping.out
96.3 kB
scf.pdoping.in
1.0 kB
scf.pdoping.out
95.3 kB
efshifting
25
50
n25
n50
Zr2Al_mpds_S379268
doping
scf.edoping.in
1.3 kB
scf.edoping.out
117.4 kB
scf.pdoping.in
1.3 kB
scf.pdoping.out
116.7 kB
efshifting
25
50
n25
n50
Zr3Sn_mpds_S261544
doping
scf.edoping.in
1.4 kB
scf.edoping.out
94.5 kB
scf.pdoping.in
1.4 kB
scf.pdoping.out
94.5 kB
efshifting
25
50
n25
n50
ZrRuSb
doping
ZrS_mpds_S527272
doping
scf.edoping.in
1.0 kB
scf.edoping.out
90.5 kB
scf.pdoping.in
1.0 kB
scf.pdoping.out
90.5 kB
efshifting
100
25
50
n100
n25
n50