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A new approach to compute atomic electrophilicity index in terms of Gordy’s electronegativity
Journal of Chemical Research ( IF 1.0 ) Pub Date : 2020-07-06 , DOI: 10.1177/1747519820937272 Poonam Yadav 1 , Hiteshi Tandon 1 , Babita Malik 1 , Tanmoy Chakraborty 2
Journal of Chemical Research ( IF 1.0 ) Pub Date : 2020-07-06 , DOI: 10.1177/1747519820937272 Poonam Yadav 1 , Hiteshi Tandon 1 , Babita Malik 1 , Tanmoy Chakraborty 2
Affiliation
Electrophilicity index is a well-known Conceptual Density Functional Theory–based reactivity descriptor to explain a wide range of physicochemical behaviours. In the present work, an attempt is mad...
中文翻译:
根据戈迪电负性计算原子亲电性指数的新方法
亲电指数是众所周知的基于概念密度泛函理论的反应性描述符,用于解释各种物理化学行为。在目前的工作中,尝试是疯狂的......
更新日期:2020-07-06
中文翻译:
根据戈迪电负性计算原子亲电性指数的新方法
亲电指数是众所周知的基于概念密度泛函理论的反应性描述符,用于解释各种物理化学行为。在目前的工作中,尝试是疯狂的......