Spectral Characterization and Molecular Dynamics Simulation of Pesticides Based on Terahertz Time-Domain Spectra Analyses and Density Functional Theory (DFT) Calculations

This work provides the experimental and theoretical fundamentals for detecting the molecular fingerprints of six kinds of pesticides by using terahertz (THz) time-domain spectroscopy (THz-TDS). The spectra of absorption coefficient and refractive index of the pesticides, chlorpyrifos, fipronil, carb...

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Detalles Bibliográficos
Autores principales: Qu, Fangfang, Lin, Lei, He, Yong, Nie, Pengcheng, Cai, Chengyong, Dong, Tao, Pan, Yi, Tang, Yu, Luo, Shaoming
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2018
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6100053/
https://www.ncbi.nlm.nih.gov/pubmed/30004436
http://dx.doi.org/10.3390/molecules23071607

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6100053/
https://www.ncbi.nlm.nih.gov/pubmed/30004436
http://dx.doi.org/10.3390/molecules23071607

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