Boron nitride nanocone as an adsorbent and senor for Ampicillin: A Computational Study

In this research, the performance of boron nitride nanocone for the detection and removal of ampicillin was investigated by infra-red (IR), natural bond orbital (NBO), frontier molecular orbital (FMO) computations. The calculated values of adsorption energy showed the interaction of ampicillin with...

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Bibliographic Details
Main Authors: Zohreh Doroudi, Mohammad Reza Jalali Sarvestani
Format: Article
Language:English
Published: Iranian Chemical Science and Technologies Association 2020-05-01
Series:Chemical Review and Letters
Subjects:
Online Access:http://www.chemrevlett.com/article_108130_85d743b970c17743c21eb1799ce2f180.pdf