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  1. Third-Parties
  2. MatprojStructure
  3. mp-975738

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-975738
  • Created at: Sept. 4, 2022, 2:47 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Pr', 'B', 'Os']
  • Chemical System: B-Os-Pr
  • Density: 11.724666927714066
  • Atomic Density: 0.06501744059689843
  • Unit Cell Volume: 153.80488539988818
  • Molar Volume: 9.262346694537955
  • Full Formula: Pr2 B4 Os4
  • Reduced Formula: Pr(BOs)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 70
  • Spacegroup Symbol: Fddd1
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -85.38965501
  • Final energy per atom: -8.538965501
  • 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.