Abstract
Spin-orbit coupling (SOC) in an Fe(II) spin-crossover system, [Fe(2-pic)3]Cl2·EtOH, where 2-pic denotes 2-picolylamine, is studied to understand the mechanism of light-induced excited spin state trapping (LIESST). The effects of SOC between the 1T1(1T2, 5E) states and the 3T2 state are larger than those between the 1T1(1T2, 5E) states and the 3T1 state. This suggests that the 3T2 state can play a significant role in the LIESST and reverse-LIESST effects.
| Original language | English |
|---|---|
| Pages (from-to) | 519-523 |
| Number of pages | 5 |
| Journal | Chemical Physics Letters |
| Volume | 372 |
| Issue number | 3-4 |
| DOIs | |
| Publication status | Published - Apr 29 2003 |
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All Science Journal Classification (ASJC) codes
- Physical and Theoretical Chemistry
- Spectroscopy
- Atomic and Molecular Physics, and Optics
Cite this
A theoretical study of spin-orbit coupling in an Fe(II) spin-crossover complex. Mechanism of the LIESST effect. / Kondo, Masakazu; Yoshizawa, Kazunari.
In: Chemical Physics Letters, Vol. 372, No. 3-4, 29.04.2003, p. 519-523.Research output: Contribution to journal › Article
}
TY - JOUR
T1 - A theoretical study of spin-orbit coupling in an Fe(II) spin-crossover complex. Mechanism of the LIESST effect
AU - Kondo, Masakazu
AU - Yoshizawa, Kazunari
PY - 2003/4/29
Y1 - 2003/4/29
N2 - Spin-orbit coupling (SOC) in an Fe(II) spin-crossover system, [Fe(2-pic)3]Cl2·EtOH, where 2-pic denotes 2-picolylamine, is studied to understand the mechanism of light-induced excited spin state trapping (LIESST). The effects of SOC between the 1T1(1T2, 5E) states and the 3T2 state are larger than those between the 1T1(1T2, 5E) states and the 3T1 state. This suggests that the 3T2 state can play a significant role in the LIESST and reverse-LIESST effects.
AB - Spin-orbit coupling (SOC) in an Fe(II) spin-crossover system, [Fe(2-pic)3]Cl2·EtOH, where 2-pic denotes 2-picolylamine, is studied to understand the mechanism of light-induced excited spin state trapping (LIESST). The effects of SOC between the 1T1(1T2, 5E) states and the 3T2 state are larger than those between the 1T1(1T2, 5E) states and the 3T1 state. This suggests that the 3T2 state can play a significant role in the LIESST and reverse-LIESST effects.
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UR - http://www.scopus.com/inward/citedby.url?scp=0037472130&partnerID=8YFLogxK
U2 - 10.1016/S0009-2614(03)00431-7
DO - 10.1016/S0009-2614(03)00431-7
M3 - Article
VL - 372
SP - 519
EP - 523
JO - Chemical Physics Letters
JF - Chemical Physics Letters
SN - 0009-2614
IS - 3-4
ER -