MatHub-3d
| Formula |
Gap (eV) |
Free Energy (eV) |
Space group type |
Space group |
Comment |
Calculation progress |
|
Er2Ir4
|
0
|
-38.229
|
'Fd-3m' |
227 |
MatHub3d-41084-Er2Ir4 |
Band
|
|
Br2F8K2
|
3.146
|
-40.020
|
'I4/mcm' |
140 |
MatHub3d-17343-Br2F8K2 |
Transport
|
|
Er1Mg1
|
0
|
-6.133
|
'Pm-3m' |
221 |
MatHub3d-40963-Er1Mg1 |
Band
|
|
Er4Mg8
|
0
|
-30.778
|
'P6_3/mmc' |
194 |
MatHub3d-41243-Er4Mg8 |
Band
|
|
Er4Ni4
|
0
|
-31.175
|
'Pnma' |
62 |
MatHub3d-41258-Er4Ni4 |
Band
|
|
Er2Ni4
|
0
|
-20.796
|
'Fd-3m' |
227 |
MatHub3d-41117-Er2Ni4 |
Band
|
|
Er1Ni5
|
0
|
-18.241
|
'P6/mmm' |
191 |
MatHub3d-40984-Er1Ni5 |
Band
|
|
Au2F8K2
|
2.963
|
-40.847
|
'I4/mcm' |
140 |
MatHub3d-7655-Au2F8K2 |
Band
|
|
Er1Ni1Sb1
|
0
|
-13.787
|
'F-43m' |
216 |
MatHub3d-40981-Er1Ni1Sb1 |
Band
|
|
Er4Ni4Sn4
|
0
|
-50.934
|
'Pnma' |
62 |
MatHub3d-41260-Er4Ni4Sn4 |
Band
|
|
Er1Os2Si2
|
0
|
-35.596
|
'I4/mmm' |
139 |
MatHub3d-40991-Er1Os2Si2 |
Band
|
|
Er1Pb3
|
0
|
-16.121
|
'Pm-3m' |
221 |
MatHub3d-40999-Er1Pb3 |
Band
|
|
Er1Pd1
|
0
|
-9.558
|
'Pm-3m' |
221 |
MatHub3d-41000-Er1Pd1 |
Band
|
|
Er1Pd3
|
0
|
-18.146
|
'Pm-3m' |
221 |
MatHub3d-41006-Er1Pd3 |
Band
|
|
Er1Pd2Sn1
|
0
|
-18.658
|
'Fm-3m' |
225 |
MatHub3d-41004-Er1Pd2Sn1 |
Band
|
|
Er3Pd3Tl3
|
0
|
-35.760
|
'P-62m' |
189 |
MatHub3d-41178-Er3Pd3Tl3 |
Band
|
|
Er2Pt4
|
0
|
-31.324
|
'Fd-3m' |
227 |
MatHub3d-41147-Er2Pt4 |
Band
|
|
Er1Pt3
|
0
|
-20.667
|
'Pm-3m' |
221 |
MatHub3d-41011-Er1Pt3 |
Band
|
|
Er8Pt4
|
0
|
-63.273
|
'Pnma' |
62 |
MatHub3d-41384-Er8Pt4 |
Band
|
|
Er2Pt4Sn2
|
0
|
-41.200
|
'P6_3/mmc' |
194 |
MatHub3d-41148-Er2Pt4Sn2 |
Band
|
|
Er1Rh1
|
0
|
-10.490
|
'Pm-3m' |
221 |
MatHub3d-41014-Er1Rh1 |
Band
|
|
Er2Rh4
|
0
|
-29.617
|
'Fd-3m' |
227 |
MatHub3d-41151-Er2Rh4 |
Band
|
|
Er1Rh5
|
0
|
-26.417
|
'P6/mmm' |
191 |
MatHub3d-41022-Er1Rh5 |
Band
|
|
Er10Rh6
|
0
|
-81.562
|
'P6_3/mcm' |
193 |
MatHub3d-41402-Er10Rh6 |
Band
|
|
Er14Rh6
|
0
|
-100.631
|
'P6_3mc' |
186 |
MatHub3d-41427-Er14Rh6 |
Band
|