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  1. Third-Parties
  2. MatprojStructure
  3. mp-1220587

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-1220587
  • Created at: Sept. 4, 2022, 2:42 p.m.
  • Last updated at: Nov. 28, 2021, 1:35 a.m.
  • Input Source: Materials Project

Structure:

  • Number of sites: 8
  • Number of elements: 3
  • Element list: ['Nb', 'V', 'Ge']
  • Chemical System: Ge-Nb-V
  • Density: 7.682587122827984
  • Atomic Density: 0.0641660540412275
  • Unit Cell Volume: 124.67651501306126
  • Molar Volume: 9.385244035936353
  • Full Formula: Nb3 V3 Ge2
  • Reduced Formula: Nb3V3Ge2
  • Formula Anonymous: A2B3C3
  • Spacegroup Number: 155
  • Spacegroup Symbol: R32H
  • Crystal System: trigonal
  • Pointgroup: 32

Thermodynamics:

  • Final energy: -68.8894214
  • Final energy per atom: -8.611177675
  • 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.