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  1. Third-Parties
  2. Materials Project

Workflow Type

Materials Project

The Materials Project at Berkeley National Labs

Source Website Cite API JSON Python-client

Filter Results:

Filter mix-ins: ['Structure', 'Thermodynamics']

Extra filters: ['energy_uncorrected__range', 'band_gap__range', 'is_gap_direct', 'is_magnetic', 'total_magnetization__range', 'is_theoretical']

Multiple values may be separated by commas.

Multiple values may be separated by commas.
Multiple values may be separated by commas.
Multiple values may be separated by commas.
Multiple values may be separated by commas.
Multiple values may be separated by commas.

Multiple values may be separated by commas.
Multiple values may be separated by commas.
Multiple values may be separated by commas.
Multiple values may be separated by commas.
Multiple values may be separated by commas.

By Extra Info:

Search Results:

ID Dashboards Full Formula Spacegroup Density
mp-1192835 simmate / provider Zr2 H12 O4 F12 15 2.729
mp-706386 simmate / provider Zr2 H12 O6 F8 2 2.730
mp-1215471 simmate / provider Zr2 H1 C1 156 6.061
mp-1215474 simmate / provider Zr2 H1 N2 Cl2 160 4.051
mp-697179 simmate / provider Zr2 H2 131 5.797
mp-707343 simmate / provider Zr2 H24 C4 N12 F12 2 1.846
mp-722263 simmate / provider Zr2 H28 C4 N16 F12 14 1.940
mp-1206023 simmate / provider Zr2 H2 Br2 164 5.419
mp-1024958 simmate / provider Zr2 H2 Cl2 164 4.341
mp-1070557 simmate / provider Zr2 H2 Pd1 139 7.393
mp-1071588 simmate / provider Zr2 H3 Pd1 139 7.035
mp-600208 simmate / provider Zr2 H72 C32 N8 O32 4 1.473