Pyrochlore structure La2Sn2O7:Eu3+ microcrystals with uniform octahedron shape were successfully synthesized via a hydrothermal route at 180 °C for 36 h. The crystal structure, particle size, morphologies, and ...Pyrochlore structure La2Sn2O7:Eu3+ microcrystals with uniform octahedron shape were successfully synthesized via a hydrothermal route at 180 °C for 36 h. The crystal structure, particle size, morphologies, and optical properties of the as-synthesized products were investigated by XRD, TEM, SEM, EDS, FT-IR, Raman spectroscopy and PL. The effects of pH of precursor solution, precursor concentration, reaction temperature, and time were investigated. The results reveal that pH of the precursor solution not only plays an important role in determining the phase of the as-synthesized products, but also has a significant influence on the morphologies of the samples. High-quality and uniform octahedrons with an average size of about 700 nm could be easily obtained at the pH value of 12. The possible formation mechanism of octahedral-like La2Sn2O7:Eu3+ microcrystals was briefly proposed. The photoluminescence spectra show that La2Sn2O7:Eu3+ micro-octahedra display stronger emission in the range of 582-592 nm compared with the samples with other shapes.展开更多
To expand knowledge on microbial communities of various metal-rich levels of mine drainage environments in Anhui province, China, the archaeal and bacterial diversities were examined using a PCR-based cloning approach...To expand knowledge on microbial communities of various metal-rich levels of mine drainage environments in Anhui province, China, the archaeal and bacterial diversities were examined using a PCR-based cloning approach. Eight acid mine water samples were collected from five areas in Tongling. Phylogenetic analyses revealed that bacteria mainly fell into ten divisions, which were Betaproteobacteria, Gammaproteobacteria, Alphaproteobacteria, Deinococcus-Thermus, Nitrospira, Firmicutes, Actinobacteria, Deltaproteobacteria, Bacteroidetes, Chloroflexi. Archaea fell into three phylogenetic divisions, Thermoplasma, Ferroplasma and Thermogymnomonas. The unweighted pair group method with arithmetic mean(UPGMA) cluster analysis based on the microbial communities’ compositions revealed that five samples shared similarity with the dominance of Meiothermus and Thermomonas. Two samples had the preponderant existence of Acidithiobacillus and Leptospirillum. The remaining sample owned higher microbial communities’ diversity with the Shannon-Weaver H up to 2.91. Canonical correlation analysis(CCA) suggested that microbial community structures had great association with p H and the concentration of Hg2+, Pb2+, Fe3+, Cl-, SO2- 4in water.展开更多
The title compound (C20H30N4O6, Mr = 422.48) was synthesized and its crystal structure was determined by X-ray diffraction method. It crystallizes in the triclinic system, space group P with cell parameters: a = 8.330...The title compound (C20H30N4O6, Mr = 422.48) was synthesized and its crystal structure was determined by X-ray diffraction method. It crystallizes in the triclinic system, space group P with cell parameters: a = 8.330(2), b = 8.468(2), c = 16.017(3) ? ?= 97.30(3), ?= 92.33(3), ?= 103.94(3)? V = 1084.7(4) ?, Dc = 1.294 g/cm3, Z = 2, F(000) = 452 and ?= 0.096 mm-1. The structure was refined to R = 0.0483 for 3732 observed reflections with I > 2s(I) and wR = 0.1335 for 4828 unique reflections. The hydantoin rings are planar and the two ring planes of one molecule are paralleled to each other.展开更多
Bis-[oxo-bis(p-ferrocenylbenzoxy di-n-propyltin)] I and bis-[oxo-bis(-ferrocenoyl- propionyloxy di-n-propyltin)] II were synthesized and their crystal structures have been determined by X-ray diffraction analysis. The...Bis-[oxo-bis(p-ferrocenylbenzoxy di-n-propyltin)] I and bis-[oxo-bis(-ferrocenoyl- propionyloxy di-n-propyltin)] II were synthesized and their crystal structures have been determined by X-ray diffraction analysis. The compound I2C6H6 ([(FcC6H4COOSnPr2)2O]22C6H6 or C92H108Fe4O10Sn42C6H6, Mr = 2384.16) is of triclinic, space group P?with a = 12.826(4), b = 13.099(5), c = 17.539(5) ? = 78.229(5), ?= 71.852(5), = 62.746(5)? V = 2483(1) ?, Z = 1, Dc = 1.490 g/cm3, = 0.71073 ? (MoK? =1.611 mm-1 and F(000) = 1128. The structure was refined to R = 0.0491 and wR = 0.1053 for 4690 unique reflections with I > 2(I). The compound IIC6H6 ([(FcCOCH2CH2COOSnPr2)2O]2C6H6 or C80H108Fe4O14Sn4C6H6, Mr = 2115.93) is of triclinic, space group P?with a = 11.260(4), b = 14.126(5), c = 15.961(6) ? = 91.400(6), = 110.654(6), = 104.931(6), V = 2277(1) 3, Z = 1, Dc = 1.510 g/cm3, = 0.71073 ? (MoK? = 1.750 mm-1 and F(000) = 1046. The structure was refined to R = 0.0466 and wR = 0.1138 for 5061 unique reflections with I > 2(I). The two compounds have the similar structures: both are dimers containing centrosymmetric Sn2O2 cores. But there are some differences in the ligating modes between the carboxylate groups and the Sn atoms.展开更多
Generating the rogue waves in offshore engineering is investigated,first of all,to forecast its occurrence to protect the offshore structure from being attacked,to study the mechanism and hydrodynamic properties of ro...Generating the rogue waves in offshore engineering is investigated,first of all,to forecast its occurrence to protect the offshore structure from being attacked,to study the mechanism and hydrodynamic properties of rouge wave experimentally as well as the rouge/structure interaction for the structure design.To achieve these purposes demands an accurate wave generation and calculation.In this paper,we establish a spatial domain model of fourth order nonlinear Schrdinger(NLS) equation for describing deep-water wave trains in the moving coordinate system.In order to generate rogue waves in the experimental tank efficiently,we take care that the transient water wave(TWW) determines precisely the concentration of time/place.First we simulate the three-dimensional wave using TWW in the numerical tank and modeling the deepwater basin with a double-side multi-segmented wave-maker in Shanghai Jiao Tong University(SJTU) under the linear superposing theory.To discuss its nonlinearity for guiding the experiment,we set the TWW as the initial condition of the NLS equation.The differences between the linear and nonlinear simulations are presented.Meanwhile,the characteristics of the transient water wave,including water particle velocity and wave slope,are investigated,which are important factors in safeguarding the offshore structures.展开更多
Most previous studies have mainly focused on the analyses of one entire network(graph) or the giant connected components of networks. In this paper, we investigate the disconnected components(non-giant connected compo...Most previous studies have mainly focused on the analyses of one entire network(graph) or the giant connected components of networks. In this paper, we investigate the disconnected components(non-giant connected component) of some real social networks, and report some interesting discoveries about structural properties of disconnected components. We study three diverse, real networks and compute the significance profile of each component. We discover some similarities in the local structure between the giant connected component and disconnected components in diverse social networks. Then we discuss how to detect network attacks based on the local structure properties of networks. Furthermore, we propose an empirical generative model called i Friends to generate networks that follow our observed patterns.展开更多
Transition metal phosphoraniminato derivatives of Keggin-type polyoxometalates(POMs) are important intermediates in N-transfer reactions.Density functional theory(DFT) has been employed to calculate the electronic str...Transition metal phosphoraniminato derivatives of Keggin-type polyoxometalates(POMs) are important intermediates in N-transfer reactions.Density functional theory(DFT) has been employed to calculate the electronic structures,bonding features and redox properties of the iron and ruthenium phosphoraniminato derivatives of Keggin-type POMs,[PW11O39{MVNPPh3}] 3-(M = Fe,Ru).Our DFT calculations show that both anions have the same qualitative M-N single bond features.However,the calculations predict that the FeN system possesses a lower energy and more accessible metalnitrogen antibonding orbital than the RuN system.This results in a greater weakening of the Fe-N bond in the reduction process,and thus enhances its N-transfer reactivity.展开更多
基金Project (07C26214301746) supported by Innovation Foundation of Ministry of Science and Technology, ChinaProject (2010GXNSFB013008) supported by Guangxi Natural Science Foundation, ChinaProject (2009bsxt001) supported by the Graduate Degree Thesis Innovation Foundation of Central South University, China
文摘Pyrochlore structure La2Sn2O7:Eu3+ microcrystals with uniform octahedron shape were successfully synthesized via a hydrothermal route at 180 °C for 36 h. The crystal structure, particle size, morphologies, and optical properties of the as-synthesized products were investigated by XRD, TEM, SEM, EDS, FT-IR, Raman spectroscopy and PL. The effects of pH of precursor solution, precursor concentration, reaction temperature, and time were investigated. The results reveal that pH of the precursor solution not only plays an important role in determining the phase of the as-synthesized products, but also has a significant influence on the morphologies of the samples. High-quality and uniform octahedrons with an average size of about 700 nm could be easily obtained at the pH value of 12. The possible formation mechanism of octahedral-like La2Sn2O7:Eu3+ microcrystals was briefly proposed. The photoluminescence spectra show that La2Sn2O7:Eu3+ micro-octahedra display stronger emission in the range of 582-592 nm compared with the samples with other shapes.
基金Project(41171418)supported by the National Natural Science Foundation of China
文摘To expand knowledge on microbial communities of various metal-rich levels of mine drainage environments in Anhui province, China, the archaeal and bacterial diversities were examined using a PCR-based cloning approach. Eight acid mine water samples were collected from five areas in Tongling. Phylogenetic analyses revealed that bacteria mainly fell into ten divisions, which were Betaproteobacteria, Gammaproteobacteria, Alphaproteobacteria, Deinococcus-Thermus, Nitrospira, Firmicutes, Actinobacteria, Deltaproteobacteria, Bacteroidetes, Chloroflexi. Archaea fell into three phylogenetic divisions, Thermoplasma, Ferroplasma and Thermogymnomonas. The unweighted pair group method with arithmetic mean(UPGMA) cluster analysis based on the microbial communities’ compositions revealed that five samples shared similarity with the dominance of Meiothermus and Thermomonas. Two samples had the preponderant existence of Acidithiobacillus and Leptospirillum. The remaining sample owned higher microbial communities’ diversity with the Shannon-Weaver H up to 2.91. Canonical correlation analysis(CCA) suggested that microbial community structures had great association with p H and the concentration of Hg2+, Pb2+, Fe3+, Cl-, SO2- 4in water.
基金This project was supported by the National Natural Science Foundation of China (No 39870983)
文摘The title compound (C20H30N4O6, Mr = 422.48) was synthesized and its crystal structure was determined by X-ray diffraction method. It crystallizes in the triclinic system, space group P with cell parameters: a = 8.330(2), b = 8.468(2), c = 16.017(3) ? ?= 97.30(3), ?= 92.33(3), ?= 103.94(3)? V = 1084.7(4) ?, Dc = 1.294 g/cm3, Z = 2, F(000) = 452 and ?= 0.096 mm-1. The structure was refined to R = 0.0483 for 3732 observed reflections with I > 2s(I) and wR = 0.1335 for 4828 unique reflections. The hydantoin rings are planar and the two ring planes of one molecule are paralleled to each other.
文摘Bis-[oxo-bis(p-ferrocenylbenzoxy di-n-propyltin)] I and bis-[oxo-bis(-ferrocenoyl- propionyloxy di-n-propyltin)] II were synthesized and their crystal structures have been determined by X-ray diffraction analysis. The compound I2C6H6 ([(FcC6H4COOSnPr2)2O]22C6H6 or C92H108Fe4O10Sn42C6H6, Mr = 2384.16) is of triclinic, space group P?with a = 12.826(4), b = 13.099(5), c = 17.539(5) ? = 78.229(5), ?= 71.852(5), = 62.746(5)? V = 2483(1) ?, Z = 1, Dc = 1.490 g/cm3, = 0.71073 ? (MoK? =1.611 mm-1 and F(000) = 1128. The structure was refined to R = 0.0491 and wR = 0.1053 for 4690 unique reflections with I > 2(I). The compound IIC6H6 ([(FcCOCH2CH2COOSnPr2)2O]2C6H6 or C80H108Fe4O14Sn4C6H6, Mr = 2115.93) is of triclinic, space group P?with a = 11.260(4), b = 14.126(5), c = 15.961(6) ? = 91.400(6), = 110.654(6), = 104.931(6), V = 2277(1) 3, Z = 1, Dc = 1.510 g/cm3, = 0.71073 ? (MoK? = 1.750 mm-1 and F(000) = 1046. The structure was refined to R = 0.0466 and wR = 0.1138 for 5061 unique reflections with I > 2(I). The two compounds have the similar structures: both are dimers containing centrosymmetric Sn2O2 cores. But there are some differences in the ligating modes between the carboxylate groups and the Sn atoms.
基金the "Knowledge-based Ship Design Hyper-Integrated Platform (KSHIP)",a key project of the Ministry of Education and the Ministry of Finance of China
文摘Generating the rogue waves in offshore engineering is investigated,first of all,to forecast its occurrence to protect the offshore structure from being attacked,to study the mechanism and hydrodynamic properties of rouge wave experimentally as well as the rouge/structure interaction for the structure design.To achieve these purposes demands an accurate wave generation and calculation.In this paper,we establish a spatial domain model of fourth order nonlinear Schrdinger(NLS) equation for describing deep-water wave trains in the moving coordinate system.In order to generate rogue waves in the experimental tank efficiently,we take care that the transient water wave(TWW) determines precisely the concentration of time/place.First we simulate the three-dimensional wave using TWW in the numerical tank and modeling the deepwater basin with a double-side multi-segmented wave-maker in Shanghai Jiao Tong University(SJTU) under the linear superposing theory.To discuss its nonlinearity for guiding the experiment,we set the TWW as the initial condition of the NLS equation.The differences between the linear and nonlinear simulations are presented.Meanwhile,the characteristics of the transient water wave,including water particle velocity and wave slope,are investigated,which are important factors in safeguarding the offshore structures.
基金supported by the National Natural Science Foundation of China (Grant Nos. 61572060, 61190125, 61472024)CERNET Innovation Project 2015 (Grant No. NGII20151004)
文摘Most previous studies have mainly focused on the analyses of one entire network(graph) or the giant connected components of networks. In this paper, we investigate the disconnected components(non-giant connected component) of some real social networks, and report some interesting discoveries about structural properties of disconnected components. We study three diverse, real networks and compute the significance profile of each component. We discover some similarities in the local structure between the giant connected component and disconnected components in diverse social networks. Then we discuss how to detect network attacks based on the local structure properties of networks. Furthermore, we propose an empirical generative model called i Friends to generate networks that follow our observed patterns.
基金support from the National Natural Science Foundation of China (20971020)the Program for Changjiang Scholars and Innovative Research Team in University(IRT0714)+1 种基金the Scientific Research Foundation for Doctor of Northeast Dianli University (BSJXM-201110)the Department of Science and Technology of Jilin Province (20082103)
文摘Transition metal phosphoraniminato derivatives of Keggin-type polyoxometalates(POMs) are important intermediates in N-transfer reactions.Density functional theory(DFT) has been employed to calculate the electronic structures,bonding features and redox properties of the iron and ruthenium phosphoraniminato derivatives of Keggin-type POMs,[PW11O39{MVNPPh3}] 3-(M = Fe,Ru).Our DFT calculations show that both anions have the same qualitative M-N single bond features.However,the calculations predict that the FeN system possesses a lower energy and more accessible metalnitrogen antibonding orbital than the RuN system.This results in a greater weakening of the Fe-N bond in the reduction process,and thus enhances its N-transfer reactivity.