Download Simmate

You can install Simmate to host your own server and access advanced features

learn more
  1. Third-Parties
  2. MatprojStructure
  3. mp-11016

Entry Data

Table mix-ins: ['Structure', 'Thermodynamics'] Extra columns: ['energy_uncorrected', 'band_gap', 'is_gap_direct', 'is_magnetic', 'total_magnetization', 'is_theoretical']

Base Information:

  • Database Entry ID: mp-11016
  • Created at: Sept. 4, 2022, 2:48 p.m.
  • Last updated at: Nov. 28, 2021, 1:38 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 11
  • Number of elements: 4
  • Element list: ['Rb', 'Cd', 'N', 'O']
  • Chemical System: Cd-N-O-Rb
  • Density: 3.352331340539267
  • Atomic Density: 0.06611295941101268
  • Unit Cell Volume: 166.38190300353864
  • Molar Volume: 9.108865816399785
  • Full Formula: Rb1 Cd1 N3 O6
  • Reduced Formula: RbCd(NO2)3
  • Formula Anonymous: ABC3D6
  • Spacegroup Number: 146
  • Spacegroup Symbol: R3H
  • Crystal System: trigonal
  • Pointgroup: 3

Thermodynamics:

  • Final energy: -67.97239748999999
  • Final energy per atom: -6.179308862727272
  • Energy above hull: None
  • Is thermodynamically stable?: None
  • Decomposes to: None
  • Formation energy None
  • Formation energy per atom: None
Note: stabilities and hull energies are updated on a running schedule, so newer materials may have these fields blank.