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  1. Third-Parties
  2. MatprojStructure
  3. mp-1071216

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-1071216
  • 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: 6
  • Number of elements: 4
  • Element list: ['Pr', 'Co', 'Si', 'C']
  • Chemical System: C-Co-Pr-Si
  • Density: 6.752889584886079
  • Atomic Density: 0.05548280514644635
  • Unit Cell Volume: 108.14161223757623
  • Molar Volume: 10.854066848467044
  • Full Formula: Pr2 Co2 Si1 C1
  • Reduced Formula: Pr2Co2SiC
  • Formula Anonymous: ABC2D2
  • Spacegroup Number: 71
  • Spacegroup Symbol: Immm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -40.97440907
  • Final energy per atom: -6.829068178333333
  • 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.