Ab Initio Study of Structure and Transport Properties of Warm Dense Nitric Oxide

Ab Initio Study of Structure and Transport Properties of Warm Dense Nitric Oxide

The structure, equation of state and transport properties of warm dense nitric oxide (NO) were investigated in wide density and temperature ranges by ab initio molecular dynamics simulations. Both the Perdew–Burke–Ernzerhof (PBE) and the strongly constrained and appropriately normed functional with...

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Bibliographic Details
Main Authors: Zhijian Fu, Xianming Zhang, Rui Wang, Huayang Sun, Yangshun Lan, Jihong Xia, Zhiguo Li, Jing Song
Format: Article
Language:English
Published: MDPI AG 2022-08-01
Series:Inorganics
Subjects:
warm dense matter
nitric oxide
structure
ab initio simulations
transport properties
Online Access:https://www.mdpi.com/2304-6740/10/8/120

Internet

https://www.mdpi.com/2304-6740/10/8/120

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