【摘 要】
:
The x-ray absorption spectroscopy is a powerful tool for the detection of thermodynamic conditions and atomic structures on warm dense matter.Here,we perform fi
【机 构】
:
Institute of Applied Physics and Computational Mathematics,Beijing 100088,China;Center for Applied P
论文部分内容阅读
The x-ray absorption spectroscopy is a powerful tool for the detection of thermodynamic conditions and atomic structures on warm dense matter.Here,we perform first-principles molecular dynamics and x-ray absorption spectrum calculations for warm dense ammonia,which is one of the major constituents of Uranus and Neptune.The nitrogen K-shell x-ray absorption spectrum (XAS) is determined along the Hugohiot curve,and it is found that the XAS is a good indicator of the prevailing thermodynamic conditions.The atomic structures at these conditions are ascertained.Results indicate that the ammonia could dissociate to NHx (x =0,1,or 2) fragments and form nitrogen clusters,and the ratios of these products change with varying conditions.The contributions to the XAS from these products show quite different characteristics,inducing the significant change of XAS along the Hugoniot curve.Further model simulations imply that the distribution of the peak position of atomic XAS is the dominant factor affecting the total XAS.
其他文献
Valley filter is a promising device for producing valley polarized current in graphene-like two-dimensional honey-comb lattice materials.The relatively large sp
Based on ab initio density functional theory calculations,we demonstrate that two carbon-doped boron nitride analog of α-graphyne structures,B3C2N3 and BC6N mo
Si-doped β-Ga2O3 films are fabricated through metal-organic chemical vapor deposition (MOCVD).Solar-blind ultraviolet (UV) photodetector (PD) based on the film
Thermal expansion control is always an obstructive factor and challenging in high precision engineering field.Here,the negative thermal expansion of NbF3 and Nb
本试验采集西藏拉萨、林芝两地共55份藏鸡腹泻粪便,参照细菌的培养特性、生化鉴定,K-B纸片法以及PCR扩增技术对样品中沙门氏菌进行分离鉴定,特异性基因鉴定,并对分离菌株进行
The nonlinear parabolized stability equations (NPSEs) approach is widely used to study the evolution of disturbances in hypersonic boundary layers owing to its
This paper aims at studying the influence mechanism of gas temperatures (300 K,400 K,500 K,and 600 K) on gas atomization by simulating the integral atomization
The spatial and temporal evolution of real contact area of contact interface with loads is a challenge.It is generally believed that there is a positive linear
An ordinary differential equation (ODE) model of tumor growth with the effect of tumor-immune interaction and chemotherapeutic drug is presented and studied.By
西藏林芝市由于常年大量使用同种药剂,造成小菜蛾对一些农药产生了抗药性。为更好地防治西藏林芝地区小菜蛾,延缓农药靶标生物抗药性发展,探索两种杀虫剂复配对小菜蛾的增效