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  1. Third-Parties
  2. MatprojStructure
  3. mp-1222062

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-1222062
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 16
  • Number of elements: 5
  • Element list: ['Mn', 'Cd', 'Cu', 'Ge', 'Se']
  • Chemical System: Cd-Cu-Ge-Mn-Se
  • Density: 5.3292124614559855
  • Atomic Density: 0.042844827814816085
  • Unit Cell Volume: 373.44064187059405
  • Molar Volume: 14.055700692809168
  • Full Formula: Mn1 Cd1 Cu4 Ge2 Se8
  • Reduced Formula: MnCdCu4(GeSe4)2
  • Formula Anonymous: ABC2D4E8
  • Spacegroup Number: 6
  • Spacegroup Symbol: P1m1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -72.43745555999999
  • Final energy per atom: -4.527340972499999
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.