Download Simmate

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

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-1220027

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-1220027
  • Created at: Sept. 4, 2022, 2:40 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 10
  • Number of elements: 4
  • Element list: ['Pr', 'Mn', 'Co', 'Ge']
  • Chemical System: Co-Ge-Mn-Pr
  • Density: 7.351449584166061
  • Atomic Density: 0.05560885036164687
  • Unit Cell Volume: 179.82749031792514
  • Molar Volume: 10.829464592120823
  • Full Formula: Pr2 Mn3 Co1 Ge4
  • Reduced Formula: Pr2Mn3CoGe4
  • Formula Anonymous: AB2C3D4
  • Spacegroup Number: 115
  • Spacegroup Symbol: P-4m2
  • Crystal System: tetragonal
  • Pointgroup: -4m2

Thermodynamics:

  • Final energy: -67.4653075
  • Final energy per atom: -6.74653075
  • 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.