Download Simmate

You can install Simmate to host your own server and access advanced features

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-867155

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-867155
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 26
  • Number of elements: 4
  • Element list: ['Sr', 'Cd', 'Sb', 'F']
  • Chemical System: Cd-F-Sb-Sr
  • Density: 5.338419585143712
  • Atomic Density: 0.032379846434445816
  • Unit Cell Volume: 802.9686012451588
  • Molar Volume: 18.598422855994837
  • Full Formula: Sr10 Cd4 Sb10 F2
  • Reduced Formula: Sr5Cd2Sb5F
  • Formula Anonymous: AB2C5D5
  • Spacegroup Number: 63
  • Spacegroup Symbol: Cmcm
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -99.23876754
  • Final energy per atom: -3.8168756746153845
  • 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.