Download Simmate

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

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-1233345

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-1233345
  • 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: 21
  • Number of elements: 4
  • Element list: ['Mg', 'Ag', 'Ru', 'O']
  • Chemical System: Ag-Mg-O-Ru
  • Density: 6.518282930295872
  • Atomic Density: 0.07835501106121318
  • Unit Cell Volume: 268.0109378530264
  • Molar Volume: 7.6857123474787485
  • Full Formula: Mg1 Ag4 Ru4 O12
  • Reduced Formula: MgAg4(RuO3)4
  • Formula Anonymous: AB4C4D12
  • Spacegroup Number: 216
  • Spacegroup Symbol: F-43m
  • Crystal System: cubic
  • Pointgroup: -43m

Thermodynamics:

  • Final energy: -130.33534501
  • Final energy per atom: -6.20644500047619
  • 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.