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']

Nelements is in range

Multiple values may be separated by commas.

Formula anonymous

Formula full

Formula reduced

Chemical system

Include chemical subsystems in results?

Nsites is in range

Multiple values may be separated by commas.

Density is in range

Multiple values may be separated by commas.

Density atomic is in range

Multiple values may be separated by commas.

Volume is in range

Multiple values may be separated by commas.

Volume molar is in range

Multiple values may be separated by commas.

Spacegroup number

Spacegroup symbol

Spacegroup crystal system

Spacegroup point group

Energy is in range

Multiple values may be separated by commas.

Energy per atom is in range

Multiple values may be separated by commas.

Energy above hull is in range

Multiple values may be separated by commas.

Is stable

Formation energy is in range

Multiple values may be separated by commas.

Formation energy is in range

Multiple values may be separated by commas.

By Extra Info:

Search Results:

This table includes 146323 results that match your search criteria. These results were filtered from the 146323 total possible results.

ID	Dashboards	Full Formula	Spacegroup	Density
mp-698272	simmate / provider	Mo₁₂ H₃₂ C₁₆ S₄ N₈ Cl₂₄ O₂₈	14	2.272
mp-1195191	simmate / provider	Mo₄ H₆₆ C₂₆ S₄ N₈ Cl₆ O₁₀	2	1.456
mp-605018	simmate / provider	Na₄ Ag₄ H₆₄ C₁₆ S₁₆ N₈ O₄₀	52	1.874
mp-18401	simmate / provider	Na₁ Al₆ Fe₃ Si₆ B₃ O₃₀ F₁	160	3.222
mp-1199124	simmate / provider	Na₄ Al₈ H₇₂ S₁₆ N₁₆ Cl₄ O₇₂	142	2.077
mp-1050641	simmate / provider	Na₆ Bi₄ H₈₄ C₃₆ I₁₈ N₁₂ O₁₈	2	2.424
mp-738637	simmate / provider	Na₆ Bi₄ H₈₄ C₃₆ I₁₈ N₁₂ O₁₈	2	2.423
mp-698491	simmate / provider	Na₂ Ca₄ Al₈ H₁₆ C₈ Cl₂ O₄₀	129	2.434
mp-1210199	simmate / provider	Na₂ Ca₂ Al₂ P₂ H₂ O₁₀ F₄	11	2.960
mp-707176	simmate / provider	Na₂ Ca₄ Al₄ P₄ H₁₀ O₂₂ F₈	11	2.870
mp-707645	simmate / provider	Na₄ Ca₆ B₁₀ H₄ S₄ Cl₂ O₃₆	15	2.638
mp-1210262	simmate / provider	Na₄ Ca₄ Be₄ Al₁ Si₇ O₂₄ F₄	82	2.848

Download Simmate

Workflow Type

Materials Project

Filter Results:

By Composition Info:

By Structure Info:

By Symmetry Info:

By Thermodynamic Info:

By Extra Info:

Search Results: