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-13355
  • 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: 14
  • Number of elements: 3
  • Element list: ['Ca', 'Nd', 'Te']
  • Chemical System: Ca-Nd-Te
  • Density: 6.390699934758754
  • Atomic Density: 0.03211109228157879
  • Unit Cell Volume: 435.98641482623736
  • Molar Volume: 18.75408256808109
  • Full Formula: Ca2 Nd4 Te8
  • Reduced Formula: Ca(NdTe2)2
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 122
  • Spacegroup Symbol: I-42d
  • Crystal System: tetragonal
  • Pointgroup: -42m