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  1. Third-Parties
  2. MatprojStructure
  3. mp-1205029

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-1205029
  • Created at: Sept. 4, 2022, 2:39 p.m.
  • Last updated at: Nov. 28, 2021, 1:34 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 70
  • Number of elements: 5
  • Element list: ['Rb', 'Nd', 'H', 'N', 'O']
  • Chemical System: H-N-Nd-O-Rb
  • Density: 2.556794610717474
  • Atomic Density: 0.07728906116566514
  • Unit Cell Volume: 905.6909081863291
  • Molar Volume: 7.791711620214729
  • Full Formula: Rb4 Nd2 H16 N10 O38
  • Reduced Formula: Rb2NdH8N5O19
  • Formula Anonymous: AB2C5D8E19
  • Spacegroup Number: 9
  • Spacegroup Symbol: C1c1
  • Crystal System: monoclinic
  • Pointgroup: m

Thermodynamics:

  • Final energy: -436.21719873
  • Final energy per atom: -6.231674267571429
  • 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.