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Baniasadi F, Fathi M, Hamidi Sangdehi S M, Tehranchi M M. Ab-initio Study of spectral absorption in (Py.H)3( FeCl4)2.Cl solution. ICOP & ICPET _ INPC _ ICOFS 2015; 21 :1517-1520
URL: http://opsi.ir/article-1-632-en.html
URL: http://opsi.ir/article-1-632-en.html
Abstract: (3155 Views)
Study of optical properties in compounds with multifunctional properties is crucial due to their potential application in fabrication of optical devices as switches, sensors and memories. In this work we have chosen solution of (Py.H)3( FeCl4)2.Cl component in Acetonitrile and investigated the spectral absorption by density functional theory. The calculations demonstrate absorption in wavelength around 520 nm and 730 nm. This result well justifies photo induced magnetism which is reported in solution at 520 nm and room temperature.
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