Download Simmate

You can install Simmate to host your own server and access advanced features

learn more

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-650858
  • Created at: Sept. 4, 2022, 2:46 p.m.
  • Last updated at: Nov. 28, 2021, 1:37 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 184
  • Number of elements: 4
  • Element list: ['Co', 'Ge', 'C', 'O']
  • Chemical System: C-Co-Ge-O
  • Density: 2.214916590796362
  • Atomic Density: 0.059508295229158965
  • Unit Cell Volume: 3092.005900882207
  • Molar Volume: 10.119834111882206
  • Full Formula: Co24 Ge8 C76 O76
  • Reduced Formula: Co6Ge2(CO)19
  • Formula Anonymous: A2B6C19D19
  • Spacegroup Number: 64
  • Spacegroup Symbol: Cmce
  • Crystal System: orthorhombic
  • Pointgroup: mmm

Thermodynamics:

  • Final energy: -1420.50588302
  • Final energy per atom: -7.720140668586957
  • 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.