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  1. Third-Parties
  2. MatprojStructure
  3. mp-1226632

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-1226632
  • Created at: Sept. 4, 2022, 2:41 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 36
  • Number of elements: 3
  • Element list: ['Cr', 'P', 'C']
  • Chemical System: C-Cr-P
  • Density: 6.288460365100796
  • Atomic Density: 0.08517402889964205
  • Unit Cell Volume: 422.6640498879969
  • Molar Volume: 7.070395562825498
  • Full Formula: Cr24 P11 C1
  • Reduced Formula: Cr24P11C
  • Formula Anonymous: AB11C24
  • Spacegroup Number: 25
  • Spacegroup Symbol: Pmm2
  • Crystal System: orthorhombic
  • Pointgroup: mm2

Thermodynamics:

  • Final energy: -312.22576194
  • Final energy per atom: -8.672937831666665
  • 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.