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-13767
  • Created at: Sept. 4, 2022, 2:36 p.m.
  • Last updated at: Sept. 4, 2022, 2:36 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 6
  • Number of elements: 2
  • Element list: ['Ta', 'O']
  • Chemical System: O-Ta
  • Density: 9.840103953125602
  • Atomic Density: 0.0834835618745969
  • Unit Cell Volume: 71.87043611067739
  • Molar Volume: 7.213564712351436
  • Full Formula: Ta2 O4
  • Reduced Formula: TaO2
  • Formula Anonymous: AB2
  • Spacegroup Number: 136
  • Spacegroup Symbol: P4_2/mnm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm