Simmate

Download Simmate

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

learn more

Due to limited resources, our website only includes a small number of features compared to the many available in the command-line and python. We highly recommend installing Simmate for local use, rather than just relying on the website.

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-972502
Created at: Sept. 4, 2022, 2:44 p.m.
Last updated at: Nov. 28, 2021, 1:36 a.m.
Input Source: Materials Project

Structure:

Number of sites: 4
Number of elements: 2
Element list: ['Sm', 'Dy']
Chemical System: Dy-Sm
Density: 7.638135826470089
Atomic Density: 0.029986589593466353
Unit Cell Volume: 133.39296179487988
Molar Volume: 20.082779808051725
Full Formula: Sm3 Dy1
Reduced Formula: Sm3Dy
Formula Anonymous: AB3
Spacegroup Number: 221
Spacegroup Symbol: Pm-3m
Crystal System: cubic
Pointgroup: m-3m

Thermodynamics:

Final energy: -18.71611031
Final energy per atom: -4.6790275775
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.