Funding
The development of CrystG3 is supported by the UMNIK grant program, Grant No. 19796ГУ/2025.
About CrystG3
CrystG3 is a searchable database of crystal structures and their G3 characteristics. It provides composition-based search, structure properties, atom-site data and interactive CIF visualization in one place.
20838
Crystal structures
73
Chemical elements represented
108785
Non-equivalent atom sites
Paid Calculations
Custom and large-volume calculations are available as a paid service. To discuss scope, timing, and pricing, contact calc@crystg3.net.
Academic Use
CrystG3 may be used for non-commercial academic research and education in accordance with the Terms of Use. When using the database or stability calculations in a publication, please cite the relevant works below and include the CrystG3 website with the date of access.
Stability of intermetallic compounds:
Geometrical and topological aspects
Intermetallics 164 (2024), 108124 ·
DOI: 10.1016/j.intermet.2023.108124
Topology of Intermetallic Crystals:
Classification, Uniformity, and Transitions
Inorganic Chemistry 63 (2024), 17881–17890 ·
DOI: 10.1021/acs.inorgchem.4c03033
APA 7th edition
CrystG3. (n.d.). CrystG3: A web service for assessing the stability of intermetallic crystal structures. Retrieved September 11, 2026, from https://crystg3.net/
GOST R 7.0.100–2018
CrystG3 : a web service for assessing the stability of intermetallic crystal structures : сайт. – URL: https://crystg3.net/ (дата обращения: 11.09.2026). – Текст : электронный.
Please also acknowledge the original crystallographic data source where appropriate.
Database Statistics
Select a chart to explore the composition and structural characteristics of the database.
Atom sites by element
Number of non-equivalent atom sites belonging to each chemical element.
Distribution of structure G3
Number of crystal structures in each G3 interval.
Distribution of structure G3 by disorder
Percentage distribution of ordered and disordered compounds across the same G3 intervals.
Most common space groups
The 20 space groups represented by the largest number of structures.
Coordination numbers
Distribution of coordination number (CN) among non-equivalent atom sites.
Average atom G3 by element
Average atom-site G3 for each chemical element; colors match the periodic table.
Order and disorder
Proportion of ordered and disordered crystal structures in the database.
Geometrical Density vs. Crystal Density
Relationship between the number of crystallographic positions per unit-cell volume and the calculated crystal density.