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-115076
  • Created at: Sept. 4, 2022, 2:38 p.m.
  • Last updated at: Sept. 4, 2022, 2:38 p.m.
  • Input Source: JARVIS

Structure:

  • Number of sites: 3
  • Number of elements: 3
  • Element list: ['Mg', 'P', 'H']
  • Chemical System: H-Mg-P
  • Density: 1.9480121136943824
  • Atomic Density: 0.06252562010956024
  • Unit Cell Volume: 47.980331818273264
  • Molar Volume: 9.631477064038277
  • Full Formula: Mg1 P1 H1
  • Reduced Formula: MgPH
  • Formula Anonymous: ABC
  • Spacegroup Number: 107
  • Spacegroup Symbol: I4mm
  • Crystal System: tetragonal
  • Pointgroup: 4mm