نتایج جستجو برای: computational study

تعداد نتایج: 4178177  

Journal: :European Journal of Organic Chemistry 2023

Abstract Thermolysis of thiirane oxide leads to production highly reactive sulfur monoxide. The liberated SO can in turn be trapped with a diene scavenger forming dihydrothiophene oxide. Since the intermediate diatomic possesses triplet ground state, transfer proceed on two spin‐state surfaces. Here, we study competition between singlet concerted and stepwise diradical mechanisms utilizing M06‐...

Journal: :Biochimica et Biophysica Acta (BBA) - Biomembranes 2017

Journal: :Journal of the Optical Society of America B 2007

Journal: :Journal of the Indian Institute of Science 2018

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