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  1. Third-Parties
  2. MatprojStructure
  3. mp-560796

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-560796
  • Created at: Sept. 4, 2022, 2:40 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: ['La', 'Mn', 'Cu', 'S']
  • Chemical System: Cu-La-Mn-S
  • Density: 5.353550206372902
  • Atomic Density: 0.0515842858514896
  • Unit Cell Volume: 407.1007217286809
  • Molar Volume: 11.674370713084318
  • Full Formula: La4 Mn1 Cu6 S10
  • Reduced Formula: La4Mn(Cu3S5)2
  • Formula Anonymous: AB4C6D10
  • Spacegroup Number: 2
  • Spacegroup Symbol: P-1
  • Crystal System: triclinic
  • Pointgroup: -1

Thermodynamics:

  • Final energy: -124.96334845
  • Final energy per atom: -5.95063564047619
  • 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.