Download Simmate

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

learn more

Entry Data

Table mix-ins: ['Structure'] Extra columns: ['energy_above_hull']

Base Information:

  • Database Entry ID: jvasp-58584
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 14
  • Number of elements: 3
  • Element list: ['Mg', 'Cu', 'O']
  • Chemical System: Cu-Mg-O
  • Density: 4.958706384488566
  • Atomic Density: 0.09704709167107417
  • Unit Cell Volume: 144.25986146448153
  • Molar Volume: 6.205379941122911
  • Full Formula: Mg2 Cu4 O8
  • Reduced Formula: Mg(CuO2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 74
  • Spacegroup Symbol: Imma
  • Crystal System: orthorhombic
  • Pointgroup: mmm