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-94797
  • Created at: Sept. 4, 2022, 2:35 p.m.
  • Last updated at: Sept. 4, 2022, 2:35 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['K', 'O', 'F']
  • Chemical System: F-K-O
  • Density: 2.4558425373726793
  • Atomic Density: 0.06566112147343996
  • Unit Cell Volume: 121.83769969929641
  • Molar Volume: 9.171547218297158
  • Full Formula: K2 O4 F2
  • Reduced Formula: KO2F
  • Formula Anonymous: ABC2
  • Spacegroup Number: 26
  • Spacegroup Symbol: Pmc2_1
  • Crystal System: orthorhombic
  • Pointgroup: mm2