Download Simmate

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

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-1293053

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-1293053
  • 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: 32
  • Number of elements: 4
  • Element list: ['Mg', 'Mn', 'Si', 'O']
  • Chemical System: Mg-Mn-O-Si
  • Density: 3.7094512424436887
  • Atomic Density: 0.0954011372322877
  • Unit Cell Volume: 335.4257708908094
  • Molar Volume: 6.312441271362391
  • Full Formula: Mg4 Mn4 Si4 O20
  • Reduced Formula: MgMnSiO5
  • Formula Anonymous: ABCD5
  • Spacegroup Number: 9
  • Spacegroup Symbol: C1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -247.59867165
  • Final energy per atom: -7.7374584890625
  • 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.