Workflow Type

Materials Project

The Materials Project at Berkeley National Labs

Source Website Cite API JSON Python-client

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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

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Formula anonymous

Formula full

Formula reduced

Chemical system

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Nsites is in range

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Density is in range

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Density atomic is in range

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Volume is in range

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Volume molar is in range

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Spacegroup number

Spacegroup symbol

Spacegroup crystal system

Spacegroup point group

Energy is in range

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Energy per atom is in range

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Energy above hull is in range

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Is stable

Formation energy is in range

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Formation energy is in range

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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-1195565	simmate / provider	V₂ Cu₁ H₁₄ C₂ N₂ O₄ F₈	2	2.346
mp-728749	simmate / provider	V₈ P₄ H₄₀ C₈ N₈ O₃₂ F₄	19	2.306
mp-556173	simmate / provider	Zn₁ As₂ C₆ S₁₂ N₁₂ O₆ F₁₂	147	2.208
mp-1201753	simmate / provider	Zn₂ Co₂ H₄₄ C₁₀ N₂₀ Cl₈ O₁₂	2	1.628
mp-728213	simmate / provider	Zn₂ Cr₂ H₅₆ C₁₂ N₂₄ Cl₁₀ O₁₆	2	1.627
mp-1194676	simmate / provider	Zn₂ H₄₈ Au₄ C₂₄ S₁₆ N₈ Cl₈	15	2.138
mp-1199187	simmate / provider	Zn₂ H₂₄ C₄ S₄ N₈ Cl₄ O₈	31	1.765
mp-1198643	simmate / provider	Zn₄ H₄₈ C₁₂ Se₄ S₁₂ N₂₄ O₁₆	29	1.984
mp-1199092	simmate / provider	Zn₄ P₄ H₂₀ C₄ N₄ Cl₄ O₁₂	14	2.290
mp-1200564	simmate / provider	Zn₂ Si₆ Ge₂ H₇₀ C₂₆ Br₂ O₂	2	1.153
mp-1199669	simmate / provider	Zn₄ Si₁₂ Ge₄ H₁₄₀ C₅₂ Cl₄ O₄	14	1.082
mp-1204520	simmate / provider	Ag₄ B₄₀ P₈ H₁₆₀ C₆₀ N₄ Cl₈ O₁₂	14	1.262

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Workflow Type

Materials Project

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