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-58261
  • Created at: Sept. 4, 2022, 2:37 p.m.
  • Last updated at: Sept. 4, 2022, 2:37 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 10
  • Number of elements: 3
  • Element list: ['Tm', 'B', 'C']
  • Chemical System: B-C-Tm
  • Density: 7.230665341708069
  • Atomic Density: 0.10146465069507342
  • Unit Cell Volume: 98.55649165986382
  • Molar Volume: 5.93521065587466
  • Full Formula: Tm2 B4 C4
  • Reduced Formula: Tm(BC)2
  • Formula Anonymous: AB2C2
  • Spacegroup Number: 127
  • Spacegroup Symbol: P4/mbm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm