Charge Transfer Interaction of Metal-Phthalocyanine Pigment and Solvent
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چکیده
منابع مشابه
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An assessment of several widely used exchange-correlation potentials in computing charge-transfer integrals is performed. In particular, we employ the recently proposed Coulomb-attenuated model which was proven by other authors to improve upon conventional functionals in the case of charge-transfer excitations. For further validation, two distinct approaches to compute the property in question ...
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ژورنال
عنوان ژورنال: Journal of the Japan Society of Colour Material
سال: 1970
ISSN: 0010-180X
DOI: 10.4011/shikizai1937.43.384