Molecular dynamics （MD） method was used to simulate 1,3,5-triamino-2,4,6-trinitrobenzene （TATB） coated with fluorine containing polymers. The mechanical properties and binding energies of PBXs were obtained. It wa...Molecular dynamics （MD） method was used to simulate 1,3,5-triamino-2,4,6-trinitrobenzene （TATB） coated with fluorine containing polymers. The mechanical properties and binding energies of PBXs were obtained. It was found that when the number of chain monomers of fluorine containing polymers was the same, the elasticity of TATB/F2314 was increased more greatly than others and the binding energy of TATB/F2311 was the largest among four PBXs. Detonation heat and velocity of such four PBXs were calculated according to theoretical and empirical formulas. The results show that the order of detonation heat is TATB〉TATB/PVDF〉TATB/F2311〉TATB/ F2314 〉 TATB/PCTFE while the order of detonation velocity is TATB/PVDF 〈 TATB/F2311 〈 TATB/F2314 〈 TATB/PCTFE 〈TATB.展开更多
The influence factors which acted on the binding performance of MIPs for GSH were discussed in this article.These factors involved the different molar ratios of monomers to templates,the various water contents and the...The influence factors which acted on the binding performance of MIPs for GSH were discussed in this article.These factors involved the different molar ratios of monomers to templates,the various water contents and the template concentrations in the test solutions containing GSH.We analyzed the characters of MIPs on the inner cavities and the functional groups according to these experimental data.展开更多
Based on the potential-energy-surface calculation,the impact of different deformation degrees of freedom on a single-particle structure and binding energies in nuclei around^(152)Nd,located on one of the hexadecapole-...Based on the potential-energy-surface calculation,the impact of different deformation degrees of freedom on a single-particle structure and binding energies in nuclei around^(152)Nd,located on one of the hexadecapole-deformation islands,is analyzed in a multi-dimensional deformation space.Various energy maps,curves and tables are presented to indicate nuclear properties.The calculated equilibrium deformations and binding energies with different potential parameters are compared with experimental data and other theories.It is found that the inclusion of the hexadecapole deformations,especially the axial one,can improve the theoretical description of both nuclear shapes and masses.In addition,our calculated potential-energy curve shows that a critical deformation-point,β_(2)≈0.4,exists—the triaxial(hexadecapole)deformation effect can be neglectable but the hexadecapole(triaxial)one plays an important role before(after)such a critical point.展开更多
The distribution of binding agents(i.e.,soil organic carbon(SOC)and glomalin-related soil protein(GRSP))in soil aggregates was influenced by many factors,such as plant characteristics and soil properties.However,how t...The distribution of binding agents(i.e.,soil organic carbon(SOC)and glomalin-related soil protein(GRSP))in soil aggregates was influenced by many factors,such as plant characteristics and soil properties.However,how these factors affect binding agents and soil aggregate stability along a climatic gradient remained unclear.We selected the Robinia pseudoacacia L.forests from semi-arid to semi-humid of the Loess Plateau,China to analyze the plant biomass,soil physical-chemical properties,SOC and GRSP distribution in different sized soil aggregates.We found that from semi-arid to semi-humid forests:(1)the proportion of macro-aggregates(>0.250 mm)significantly increased(P<0.05),whereas those of micro-aggregates(0.250–0.053 mm)and fine materials(<0.053 mm)decreased and soil aggregate stability was increased;(2)the contents of SOC and GRSP in macro-aggregates and micro-aggregates significantly increased,and those in fine materials decreased;(3)the contribution of SOC to soil aggregate stability was greater than those of total GRSP and easily extractable GRSP;(4)soil properties had greater influence on binding agents than plant biomass;and(5)soil aggregate stability was enhanced by increasing the contents of SOC and GRSP in macro-aggregates and soil property was the important part during this process.Climate change from semi-arid to semi-humid forests is important factor for soil structure formation because of its positive effect on soil aggregates.展开更多
基金Project supported by the Significant Fundation of China Academy of Engineering Physics （No. 2004Z0503） and the National Natural Science Foundation of China （No. 10176012）.
文摘Molecular dynamics （MD） method was used to simulate 1,3,5-triamino-2,4,6-trinitrobenzene （TATB） coated with fluorine containing polymers. The mechanical properties and binding energies of PBXs were obtained. It was found that when the number of chain monomers of fluorine containing polymers was the same, the elasticity of TATB/F2314 was increased more greatly than others and the binding energy of TATB/F2311 was the largest among four PBXs. Detonation heat and velocity of such four PBXs were calculated according to theoretical and empirical formulas. The results show that the order of detonation heat is TATB〉TATB/PVDF〉TATB/F2311〉TATB/ F2314 〉 TATB/PCTFE while the order of detonation velocity is TATB/PVDF 〈 TATB/F2311 〈 TATB/F2314 〈 TATB/PCTFE 〈TATB.
文摘The influence factors which acted on the binding performance of MIPs for GSH were discussed in this article.These factors involved the different molar ratios of monomers to templates,the various water contents and the template concentrations in the test solutions containing GSH.We analyzed the characters of MIPs on the inner cavities and the functional groups according to these experimental data.
基金supported by the National Natural Science Foundation of China(No.11975209,No.U2032211,No.12075287)the Physics Research and Development Program of Zhengzhou University(No.32410017)the Project of Youth Backbone Teachers of Colleges and Universities of Henan Province(No.2017GGJS008)。
文摘Based on the potential-energy-surface calculation,the impact of different deformation degrees of freedom on a single-particle structure and binding energies in nuclei around^(152)Nd,located on one of the hexadecapole-deformation islands,is analyzed in a multi-dimensional deformation space.Various energy maps,curves and tables are presented to indicate nuclear properties.The calculated equilibrium deformations and binding energies with different potential parameters are compared with experimental data and other theories.It is found that the inclusion of the hexadecapole deformations,especially the axial one,can improve the theoretical description of both nuclear shapes and masses.In addition,our calculated potential-energy curve shows that a critical deformation-point,β_(2)≈0.4,exists—the triaxial(hexadecapole)deformation effect can be neglectable but the hexadecapole(triaxial)one plays an important role before(after)such a critical point.
基金the National Key Research and Development Program of China(2017YFC0504601)the National Natural Science Foundation of China(41671513).
文摘The distribution of binding agents(i.e.,soil organic carbon(SOC)and glomalin-related soil protein(GRSP))in soil aggregates was influenced by many factors,such as plant characteristics and soil properties.However,how these factors affect binding agents and soil aggregate stability along a climatic gradient remained unclear.We selected the Robinia pseudoacacia L.forests from semi-arid to semi-humid of the Loess Plateau,China to analyze the plant biomass,soil physical-chemical properties,SOC and GRSP distribution in different sized soil aggregates.We found that from semi-arid to semi-humid forests:(1)the proportion of macro-aggregates(>0.250 mm)significantly increased(P<0.05),whereas those of micro-aggregates(0.250–0.053 mm)and fine materials(<0.053 mm)decreased and soil aggregate stability was increased;(2)the contents of SOC and GRSP in macro-aggregates and micro-aggregates significantly increased,and those in fine materials decreased;(3)the contribution of SOC to soil aggregate stability was greater than those of total GRSP and easily extractable GRSP;(4)soil properties had greater influence on binding agents than plant biomass;and(5)soil aggregate stability was enhanced by increasing the contents of SOC and GRSP in macro-aggregates and soil property was the important part during this process.Climate change from semi-arid to semi-humid forests is important factor for soil structure formation because of its positive effect on soil aggregates.
