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-21565
  • 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: 16
  • Number of elements: 2
  • Element list: ['Mo', 'P']
  • Chemical System: Mo-P
  • Density: 8.979314975778223
  • Atomic Density: 0.0678491302865575
  • Unit Cell Volume: 235.8173189903066
  • Molar Volume: 8.875781803784047
  • Full Formula: Mo12 P4
  • Reduced Formula: Mo3P
  • Formula Anonymous: AB3
  • Spacegroup Number: 121
  • Spacegroup Symbol: I-42m
  • Crystal System: tetragonal
  • Pointgroup: -42m