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  1. Third-Parties
  2. MatprojStructure
  3. mp-1228096

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-1228096
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 180
  • Number of elements: 3
  • Element list: ['K', 'Cu', 'Sn']
  • Chemical System: Cu-K-Sn
  • Density: 4.390583838110194
  • Atomic Density: 0.031944875596535506
  • Unit Cell Volume: 5634.706557427365
  • Molar Volume: 18.851664461179226
  • Full Formula: K48 Cu48 Sn84
  • Reduced Formula: K4Cu4Sn7
  • Formula Anonymous: A4B4C7
  • Spacegroup Number: 111
  • Spacegroup Symbol: P-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m

Thermodynamics:

  • Final energy: -623.42379095
  • Final energy per atom: -3.4634655052777776
  • 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.