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  1. Third-Parties
  2. MatprojStructure
  3. mp-1215670

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-1215670
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:39 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 5
  • Element list: ['Zn', 'Cu', 'Sn', 'Se', 'S']
  • Chemical System: Cu-S-Se-Sn-Zn
  • Density: 5.2345127945509375
  • Atomic Density: 0.04346827111287361
  • Unit Cell Volume: 184.04228636622062
  • Molar Volume: 13.854106928620118
  • Full Formula: Zn1 Cu2 Sn1 Se3 S1
  • Reduced Formula: ZnCu2SnSe3S
  • Formula Anonymous: ABCD2E3
  • Spacegroup Number: 1
  • Spacegroup Symbol: P1
  • Crystal System: triclinic
  • Pointgroup: 1

Thermodynamics:

  • Final energy: -33.25358467
  • Final energy per atom: -4.15669808375
  • 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.