Quantum Chemical Approach for Organic Ferromagnetic Material Design

• Κύριοι συγγραφείς: Aoki, Yuriko (Συγγραφέας), Orimoto, Yuuichi (Συγγραφέας), Imamura, Akira (Συγγραφέας)
• Συγγραφή απο Οργανισμό/Αρχή: SpringerLink (Online service)
• Μορφή: Ηλεκτρονική πηγή Ηλ. βιβλίο
• Γλώσσα: English
• Έκδοση: Cham : Springer International Publishing : Imprint: Springer, 2017.
• Σειρά: SpringerBriefs in Molecular Science,
• Θέματα: Chemistry.; Physical chemistry.; Chemistry, Physical and theoretical.; Magnetism.; Magnetic materials.; Theoretical and Computational Chemistry.; Physical Chemistry.; Magnetism, Magnetic Materials.

This brief provides an overview of theoretical research in organic ferromagnetic material design using quantum chemical approaches based on molecular orbital theory from primary Hückel to ab initio levels of theory. Most of the content describes the authors’ approach to identify simple and efficient...