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  1. Third-Parties
  2. MatprojStructure
  3. mp-1180754

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-1180754
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 152
  • Number of elements: 4
  • Element list: ['Na', 'Sr', 'Cr', 'F']
  • Chemical System: Cr-F-Na-Sr
  • Density: 3.634340255403941
  • Atomic Density: 0.07087912270590259
  • Unit Cell Volume: 2144.496068760483
  • Molar Volume: 8.496353411409386
  • Full Formula: Na12 Sr16 Cr20 F104
  • Reduced Formula: Na3Sr4Cr5F26
  • Formula Anonymous: A3B4C5D26
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -955.71041483
  • Final energy per atom: -6.287568518618421
  • 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.