Abstract
The neutral-ionic transformation in mixed-stack organic charge-transfer (CT) crystals has been analysed within a phenomenological theory. The theory uses two parameters: lattice distortion (the stack dimerization) which breaks inversion symmetry and molecular deformation (related to molecular ionicity) which preserves site symmetry. A coupling of totally symmetric molecular vibrations with a charge-transfer between donor and acceptor molecules allows to introduce the concept of molecular compressibility which includes both elastic and electronic contributions. The concept helps to understand discontinuity of the neutral-ionic transformation and can be usefull in the theory of solid state chemistry.
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.