Thermodynamics study of biokerosene from coconut and palm kernel oils and JP-8 aircraft fuels in the gas phase by the DFT method
ES Moraes, GF Reis, J Cruz, K Cozzolino… - Journal of Molecular …, 2020 - Springer
In this work, we performed a theoretical density functional theory (DFT) and semi-empirical
(PM3) analysis to calculate thermodynamic properties of biokerosene from coconut and …
(PM3) analysis to calculate thermodynamic properties of biokerosene from coconut and …
Heavy metals nanofiltration using nanotube and electric field by molecular dynamics
TS Arouche, RMS Cavaleiro… - Journal of …, 2020 - Wiley Online Library
Heavy metal contamination in the world is increasing the impact on the environment and
human life. Currently, carbon nanotubes and boron are some possible ideals for the …
human life. Currently, carbon nanotubes and boron are some possible ideals for the …
Removal of Organic Pollutants Benzene and Phenol Using Nanofiltration: A Molecular Dynamics Study
IG Medeiros, JN Cruz, MS Oliveira… - … of Nanoscience and …, 2019 - ingentaconnect.com
Population growth has resulted in an increased demand for clean water. It is known that
chemical pollutants such as phenol and benzene often make water unfit for consumption …
chemical pollutants such as phenol and benzene often make water unfit for consumption …
Dinâmica molecular do nanotubo de carbono com os agrotóxicos fipronil e glifosato
LKV Gomes, LHV Gomes, JCM Amaral… - The Journal of …, 2023 - beta.periodicos.ufv.br
Nesta pesquisa realizamos a dinâmica molecular das moléculas de Fipronil e glifosato
interagindo individualmente com uma secção de nanotubo de carbono, a fim de verificar o …
interagindo individualmente com uma secção de nanotubo de carbono, a fim de verificar o …