TY  - BOOK
AU  - Nakano,Masayoshi
ED  - SpringerLink (Online service)
TI  - Excitation Energies and Properties of Open-Shell Singlet Molecules: Applications to a New Class of Molecules for Nonlinear Optics and Singlet Fission 
T2  - SpringerBriefs in Molecular Science,
SN  - 9783319081205
AV  - QD450-882 
U1  - 541 23
PY  - 2014///
CY  - Cham
PB  - Springer International Publishing, Imprint: Springer
KW  - chemistry
KW  - Chemistry, Physical organic
KW  - Optical materials
KW  - Chemistry
KW  - Physical Chemistry
KW  - Optical and Electronic Materials
KW  - Atomic, Molecular, Optical and Plasma Physics
N1  - Introduction -- Electronic Structures of Symmetric Diradical Systems -- Electronic Structures of Asymmetric Diradical Systems -- Diradical Character View of (Non)linear Optical Properties -- Diradical Character View of Singlet Fission -- Summary
N2  - This brief investigates the diradical character, which is one of the ground-state chemical indices for "bond weakness" or "electron correlation" and which allows researchers to explore the origins of the electron-correlation-driven physico-chemical phenomena concerned with electronic, optical and magnetic properties as well as to control them in the broad fields of physics and chemistry. It then provides the theoretical fundamentals of ground and excited electronic structures of symmetric and asymmetric open-shell molecular systems by using model molecular systems. Moreover, it presents the theoretical design guidelines for a new class of open-shell singlet molecular systems for nonlinear optics (NLO) and singlet fission
UR  - http://dx.doi.org/10.1007/978-3-319-08120-5
ER  -