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-59215
  • 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: 22
  • Number of elements: 3
  • Element list: ['Hg', 'Mo', 'O']
  • Chemical System: Hg-Mo-O
  • Density: 6.897909961142391
  • Atomic Density: 0.06480934306926787
  • Unit Cell Volume: 339.45722882095134
  • Molar Volume: 9.292087336178627
  • Full Formula: Hg4 Mo4 O14
  • Reduced Formula: Hg2Mo2O7
  • Formula Anonymous: A2B2C7
  • Spacegroup Number: 13
  • Spacegroup Symbol: P12/c1
  • Crystal System: monoclinic
  • Pointgroup: 2/m