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  1. Third-Parties
  2. MatprojStructure
  3. mp-1183624

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-1183624
  • 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: 4
  • Number of elements: 2
  • Element list: ['Cd', 'Ni']
  • Chemical System: Cd-Ni
  • Density: 9.001219706309797
  • Atomic Density: 0.05476433205951015
  • Unit Cell Volume: 73.04024078397165
  • Molar Volume: 10.996465278634252
  • Full Formula: Cd3 Ni1
  • Reduced Formula: Cd3Ni
  • Formula Anonymous: AB3
  • Spacegroup Number: 221
  • Spacegroup Symbol: Pm-3m
  • Crystal System: cubic
  • Pointgroup: m-3m

Thermodynamics:

  • Final energy: -8.20948096
  • Final energy per atom: -2.05237024
  • 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.