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-16114
  • 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: 6
  • Number of elements: 3
  • Element list: ['Mg', 'Ni', 'P']
  • Chemical System: Mg-Ni-P
  • Density: 5.447166983885515
  • Atomic Density: 0.07698450593092064
  • Unit Cell Volume: 77.93776068893513
  • Molar Volume: 7.822536089799364
  • Full Formula: Mg2 Ni3 P1
  • Reduced Formula: Mg2Ni3P
  • Formula Anonymous: AB2C3
  • Spacegroup Number: 166
  • Spacegroup Symbol: R-3mH
  • Crystal System: trigonal
  • Pointgroup: -3m