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-8608
  • 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: 7
  • Number of elements: 3
  • Element list: ['Rb', 'Ca', 'H']
  • Chemical System: Ca-H-Rb
  • Density: 2.4340600137124455
  • Atomic Density: 0.047714474835219046
  • Unit Cell Volume: 146.706005340609
  • Molar Volume: 12.621203064263703
  • Full Formula: Rb2 Ca1 H4
  • Reduced Formula: Rb2CaH4
  • Formula Anonymous: AB2C4
  • Spacegroup Number: 139
  • Spacegroup Symbol: I4/mmm
  • Crystal System: tetragonal
  • Pointgroup: 4/mmm