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  1. Third-Parties
  2. MatprojStructure
  3. mp-1228924

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-1228924
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 4
  • Element list: ['Al', 'Cr', 'Si', 'Mo']
  • Chemical System: Al-Cr-Mo-Si
  • Density: 7.61246737496055
  • Atomic Density: 0.07351471845838423
  • Unit Cell Volume: 108.82174573692616
  • Molar Volume: 8.191748382208742
  • Full Formula: Al1 Cr3 Si1 Mo3
  • Reduced Formula: AlCr3SiMo3
  • Formula Anonymous: ABC3D3
  • Spacegroup Number: 146
  • Spacegroup Symbol: R3H
  • Crystal System: trigonal
  • Pointgroup: 3

Thermodynamics:

  • Final energy: -72.33561157
  • Final energy per atom: -9.04195144625
  • 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.