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  1. Third-Parties
  2. MatprojStructure
  3. mp-561571

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-561571
  • Created at: Sept. 4, 2022, 2:43 p.m.
  • Last updated at: Nov. 28, 2021, 1:36 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 108
  • Number of elements: 5
  • Element list: ['Co', 'Sn', 'H', 'O', 'F']
  • Chemical System: Co-F-H-O-Sn
  • Density: 2.7240608237155897
  • Atomic Density: 0.08543521313598103
  • Unit Cell Volume: 1264.1157672083552
  • Molar Volume: 7.048780636170471
  • Full Formula: Co4 Sn8 H48 O24 F24
  • Reduced Formula: CoSn2H12(OF)6
  • Formula Anonymous: AB2C6D6E12
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -570.4824998700001
  • Final energy per atom: -5.2822453691666675
  • 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.