Abstract
The programs SINDBAD (batch) and STRUMO (interactive) use a chemical bond model to examine structures retrieved from the Inorganic Crystal Structure Database. The bonding topology at any desired level of bond strength is determined from the bonds (and their valences) calculated directly from the atomic coordinates stored in the database. Hydrogen bonding, disorder, internal stress, defects, and diffusion paths can be examined and modeled by using related techniques
Talk to us
Join us for a 30 min session where you can share your feedback and ask us any queries you have
Disclaimer: All third-party content on this website/platform is and will remain the property of their respective owners and is provided on "as is" basis without any warranties, express or implied. Use of third-party content does not indicate any affiliation, sponsorship with or endorsement by them. Any references to third-party content is to identify the corresponding services and shall be considered fair use under The CopyrightLaw.