The Monte Carlo simulators with the three valley model and the full band Monte Carlo model are used to explore electron transport in bulk wurtzite gallium nitride (GaN).Comparison of the results based on the two mode...The Monte Carlo simulators with the three valley model and the full band Monte Carlo model are used to explore electron transport in bulk wurtzite gallium nitride (GaN).Comparison of the results based on the two models is made.The results based on both models are basically the same at the lower field region,but exhibit some differences at the higher field region.The electron average energy exhibits obvious difference at the high field region between the two models.This difference further causes several other differences of GaN properties,such as the drift velocity versus field characteristics,the repopulation.Because of the complicated energy band structures at the high energy region for wurtzite GaN,the analytical band structures in the three valley model can not cover all properties of the band structures of wurtzite GaN,so the results based on the full band Monte Carlo model should be more exact.展开更多
3D visualization is one of major problems in “Digital Mine” theory and its technological research field. Through the observation of 3D geological models, spatial structural information, connected with the informatio...3D visualization is one of major problems in “Digital Mine” theory and its technological research field. Through the observation of 3D geological models, spatial structural information, connected with the information of production management hidden in geological data, could be detected. In order to meet the requirement of more efficient coal exploration, a case study of geological characters of the Daliuta Coal Mine is presented in which 3D visual models of the ground surface and geologic bodies are established on the basis of data models and data structures of 3D geology modeling. The main conclusions of this study are as follows: (1) Through analysis and organization of spatial discrete data, the drillhole database is designed with the data of the Daliuta mine; the connections amomg drillhole data are real- ized and displayed in a 3D environment. (2) Combining real data of the Daliuta mine, drillhole visualization is realized in a 3D environment by using the CoalMiner system. (3) The ground surface modeling of the Daliuta coal mine adopted a surface-data model and a TIN data structure. (4) 3D models of coal seams and rock formations of the Daliuta mine are established, which provide a method for the simulation of complex surfaces of geologic bodies. In the end, the models are applied to the Daliuta coal mine and the result shows that better geological effects are obtained.展开更多
The mechanism of leaching chalcopyrite by Acidithiobacillus ferrooxidans （,4. ferrooxidans） in agar-simulated extracellular polymeric substances （EPS） media was investigated. The results indicate that bacterial EP...The mechanism of leaching chalcopyrite by Acidithiobacillus ferrooxidans （,4. ferrooxidans） in agar-simulated extracellular polymeric substances （EPS） media was investigated. The results indicate that bacterial EPS can release H＋ and concentrate Fe3＋; Fe2＋ is movable between agar-simulated EPS phase and bulk solution phase, but it is difficult for Fe3＋ to move due to its hydroxylation and EPS complex action; A. ferrooxidans first prefer Fe2＋ as energy to metabolize compared with chalcopyrite, and a suitable simulated EPS environment for bacterial living is at about pH 1.8; the iron precipitates and jarosites formed by a lot of biologically oxidized Fe3 cover the simulated EPS easily and form an impermeable deposit acting as a limited barrier of ion transport that attenuates the aggressiveness of the bioleaching attack. The EPS layer blocked by iron precipitates or jarosites is responsible for the chalcopyrite passivation.展开更多
Proposed a novel approach to the problem of mine complex fields in a perspective of digital modeling and visual representation, and it aimed at developing a theoretical framework for mine complex fields with the facto...Proposed a novel approach to the problem of mine complex fields in a perspective of digital modeling and visual representation, and it aimed at developing a theoretical framework for mine complex fields with the factors and their relationships delineated in a unified manner and at building a prototype for an integrated system of methods, models, and techniques with mine complex fields modeled digitally and represented visually. Specifically, the paper addressed the issues of data mining and knowledge discovery techniques as used in the processing of geological and ore deposit samples, digital modeling techniques as used in the description of mine complex fields, 3D visual simulation techniques as used in the representation of ore bodies and underground excavations, seamless interfacing techniques with other systems such as CAD and web GIS as used in the restructuring of 2D data into 3D models and mapping of 3D models onto 2D graphics, and implementation techniques as used in the case of building a web based prototype system for the integrated modeling and visualization of underground mines.展开更多
The Xiangshan deposit in Jiangxi province is one of the most important uranium deposits in China. The aim of this study is to achieve a better understanding of mineralization in the Xiangshan deposit through numerical...The Xiangshan deposit in Jiangxi province is one of the most important uranium deposits in China. The aim of this study is to achieve a better understanding of mineralization in the Xiangshan deposit through numerical simulation. In order to find the most favorable locations of mineralization and to help further mineral exploration, a coupling deforma- tion and fluid flow model has been established to describe the mineralization process. In this model, the simulation re- constructs the strata deformations under fields of compressive stress and thrust structure on the hanging wall of the Zou-Shi fault. Compared with practical information, the simulation results are consistent with the No. 51 exploration section of the western Xiangshan. In addition, on the basis of geological information provided by previous investigators, the model simulates the flow process of fluids under compressive stress fields. The result suggests that many tensional areas are formed, which can help the fluid flowing upward from deeper parts. The fluid is easy to concentrate on the breccia fractured zone between two volcanic layers, especially on the intersection parts with faults, resulting in the for- mation of favourable locations of mineralization. In addition, the model is significant in guiding the exploration of ura- nium deposits in the western Xiangshan and provides clues for further exploration of deposits.展开更多
Based on the analysis of whole mining process in metal mines, it was pointed out that the investigation of the heavy metal pollution of tailings should be taken as an important project for a metal mine. Combined with ...Based on the analysis of whole mining process in metal mines, it was pointed out that the investigation of the heavy metal pollution of tailings should be taken as an important project for a metal mine. Combined with the anlysis of the characteristics of tailings, it is found that the transformation of the heavy metal dissolution process, the heavy metal ions migration with groundwater and the heavy metal transport in porous media are three key aspects. Accordingly, the models of heavy metal pollution were established with providing boundary conditions. Depending upon a case of Ibnglushan Copper Mine railings and its relevant area from Google maps＇, a three-dimensional grid view of the tailings was set up. By application of Fluent software, the contaminated process of the heavy metal pollutants in the tailings was shown through digital visualization pattern.展开更多
A mathematical model for enargite bioleaching at 70℃ by Sulfolobus BC in shake-flasks has been constructed. The model included （1） the indirect leaching by Fe^3＋ and Fe^3＋ regeneration by suspended Sulfolobus, a...A mathematical model for enargite bioleaching at 70℃ by Sulfolobus BC in shake-flasks has been constructed. The model included （1） the indirect leaching by Fe^3＋ and Fe^3＋ regeneration by suspended Sulfolobus, and （2） the direct leaching by the attached Sulfolobus. The model parameters were optimized using genetic algorithm （GA）. Simulations of the ferric leaching, and bioleaching processes were done using this model. The dynamic changes of the concentrations of Cu^2＋, As^3＋, As^5＋, Fe^3＋ and/or Fe^2＋, as well as ferric-arsenate precipitation were accurately predicted.展开更多
Emission of carbon dioxide is considered to be the main cause of the greenhouse effect. Mineral carbonation, an important part of the CCS technology, is an attractive option for long-term CO2 sequestration. In this st...Emission of carbon dioxide is considered to be the main cause of the greenhouse effect. Mineral carbonation, an important part of the CCS technology, is an attractive option for long-term CO2 sequestration. In this study, wollastonite was chosen as the feedstock and the feasibility of direct aqueous mineral carbonation in the simulated flue gas was investigated via a series of experimental studies carried in a stirred reactor. X-ray diffraction （XRD）, X-ray fluorescence spectroscopy （XRF）, ion chro- matography （IC） and thermal decomposition were used to determine the carbonation conversion. The influences of various factors, including reaction temperature, reaction pressure, solution composition, heat-treatment and particle size, were dis- cussed. Concurrently, the effects of SO2 and NO presented in simulated flue gas were also investigated and a possible mecha- nism was used to explain the results. Experimental results show that reaction temperature, reaction pressure and particle size can effectively improve the carbonation reaction. Addition of 0.6 M NaHCO3 was also proved to be beneficial to the reaction and heat-treatment is not needed for wollastonite to get a higher carbonation conversion. Compared with carbonation in puri- fied CO2 gas, CO2 sequestration directly from simulated flue gas by mineral carbonation is suggested to have a certain degree of economic feasibility in the conditions of medium and low-pressure. A highest carbonation conversion of 35.9% is gained on the condition of T=150℃, P=40 bar and PS 〈30 μ in distilled water for 1 h.展开更多
文摘The Monte Carlo simulators with the three valley model and the full band Monte Carlo model are used to explore electron transport in bulk wurtzite gallium nitride (GaN).Comparison of the results based on the two models is made.The results based on both models are basically the same at the lower field region,but exhibit some differences at the higher field region.The electron average energy exhibits obvious difference at the high field region between the two models.This difference further causes several other differences of GaN properties,such as the drift velocity versus field characteristics,the repopulation.Because of the complicated energy band structures at the high energy region for wurtzite GaN,the analytical band structures in the three valley model can not cover all properties of the band structures of wurtzite GaN,so the results based on the full band Monte Carlo model should be more exact.
基金Project 2002CB412601 supported by Chinese Ministry of Science and Technology
文摘3D visualization is one of major problems in “Digital Mine” theory and its technological research field. Through the observation of 3D geological models, spatial structural information, connected with the information of production management hidden in geological data, could be detected. In order to meet the requirement of more efficient coal exploration, a case study of geological characters of the Daliuta Coal Mine is presented in which 3D visual models of the ground surface and geologic bodies are established on the basis of data models and data structures of 3D geology modeling. The main conclusions of this study are as follows: (1) Through analysis and organization of spatial discrete data, the drillhole database is designed with the data of the Daliuta mine; the connections amomg drillhole data are real- ized and displayed in a 3D environment. (2) Combining real data of the Daliuta mine, drillhole visualization is realized in a 3D environment by using the CoalMiner system. (3) The ground surface modeling of the Daliuta coal mine adopted a surface-data model and a TIN data structure. (4) 3D models of coal seams and rock formations of the Daliuta mine are established, which provide a method for the simulation of complex surfaces of geologic bodies. In the end, the models are applied to the Daliuta coal mine and the result shows that better geological effects are obtained.
基金Project(2010CB630900) supported by the National Basic Research Program of ChinaProject(50621063) supported by the National Nature Science Foundation of China
文摘The mechanism of leaching chalcopyrite by Acidithiobacillus ferrooxidans （,4. ferrooxidans） in agar-simulated extracellular polymeric substances （EPS） media was investigated. The results indicate that bacterial EPS can release H＋ and concentrate Fe3＋; Fe2＋ is movable between agar-simulated EPS phase and bulk solution phase, but it is difficult for Fe3＋ to move due to its hydroxylation and EPS complex action; A. ferrooxidans first prefer Fe2＋ as energy to metabolize compared with chalcopyrite, and a suitable simulated EPS environment for bacterial living is at about pH 1.8; the iron precipitates and jarosites formed by a lot of biologically oxidized Fe3 cover the simulated EPS easily and form an impermeable deposit acting as a limited barrier of ion transport that attenuates the aggressiveness of the bioleaching attack. The EPS layer blocked by iron precipitates or jarosites is responsible for the chalcopyrite passivation.
基金Supported by National Key Technology R＆D Program（2006BAK04B04） National Natural Science Foundation of China（50604003） Specialized Research Fund for the Doctoral Program of Higher Education（2006008005）
文摘Proposed a novel approach to the problem of mine complex fields in a perspective of digital modeling and visual representation, and it aimed at developing a theoretical framework for mine complex fields with the factors and their relationships delineated in a unified manner and at building a prototype for an integrated system of methods, models, and techniques with mine complex fields modeled digitally and represented visually. Specifically, the paper addressed the issues of data mining and knowledge discovery techniques as used in the processing of geological and ore deposit samples, digital modeling techniques as used in the description of mine complex fields, 3D visual simulation techniques as used in the representation of ore bodies and underground excavations, seamless interfacing techniques with other systems such as CAD and web GIS as used in the restructuring of 2D data into 3D models and mapping of 3D models onto 2D graphics, and implementation techniques as used in the case of building a web based prototype system for the integrated modeling and visualization of underground mines.
基金Projects GPMR0547 supported by the State Key Laboratory of Geological Processes and Mineral Resources, China University of Geosciences, and 2002 CB 412601 by the Chinese Ministry of Science and Technology
文摘The Xiangshan deposit in Jiangxi province is one of the most important uranium deposits in China. The aim of this study is to achieve a better understanding of mineralization in the Xiangshan deposit through numerical simulation. In order to find the most favorable locations of mineralization and to help further mineral exploration, a coupling deforma- tion and fluid flow model has been established to describe the mineralization process. In this model, the simulation re- constructs the strata deformations under fields of compressive stress and thrust structure on the hanging wall of the Zou-Shi fault. Compared with practical information, the simulation results are consistent with the No. 51 exploration section of the western Xiangshan. In addition, on the basis of geological information provided by previous investigators, the model simulates the flow process of fluids under compressive stress fields. The result suggests that many tensional areas are formed, which can help the fluid flowing upward from deeper parts. The fluid is easy to concentrate on the breccia fractured zone between two volcanic layers, especially on the intersection parts with faults, resulting in the for- mation of favourable locations of mineralization. In addition, the model is significant in guiding the exploration of ura- nium deposits in the western Xiangshan and provides clues for further exploration of deposits.
文摘Based on the analysis of whole mining process in metal mines, it was pointed out that the investigation of the heavy metal pollution of tailings should be taken as an important project for a metal mine. Combined with the anlysis of the characteristics of tailings, it is found that the transformation of the heavy metal dissolution process, the heavy metal ions migration with groundwater and the heavy metal transport in porous media are three key aspects. Accordingly, the models of heavy metal pollution were established with providing boundary conditions. Depending upon a case of Ibnglushan Copper Mine railings and its relevant area from Google maps＇, a three-dimensional grid view of the tailings was set up. By application of Fluent software, the contaminated process of the heavy metal pollutants in the tailings was shown through digital visualization pattern.
基金Supported by the State Key Development Program for Basic Research of China （2004CB619202） and the National Natural Science Foundation of China （50174034, 30170026）.
文摘A mathematical model for enargite bioleaching at 70℃ by Sulfolobus BC in shake-flasks has been constructed. The model included （1） the indirect leaching by Fe^3＋ and Fe^3＋ regeneration by suspended Sulfolobus, and （2） the direct leaching by the attached Sulfolobus. The model parameters were optimized using genetic algorithm （GA）. Simulations of the ferric leaching, and bioleaching processes were done using this model. The dynamic changes of the concentrations of Cu^2＋, As^3＋, As^5＋, Fe^3＋ and/or Fe^2＋, as well as ferric-arsenate precipitation were accurately predicted.
基金supported by the National Natural Science Foundation of China (Grant Nos. 40972102, 41172140)the National Basic Research Program of China ("973" Project) (Grant No. 2011CB201500)
文摘Emission of carbon dioxide is considered to be the main cause of the greenhouse effect. Mineral carbonation, an important part of the CCS technology, is an attractive option for long-term CO2 sequestration. In this study, wollastonite was chosen as the feedstock and the feasibility of direct aqueous mineral carbonation in the simulated flue gas was investigated via a series of experimental studies carried in a stirred reactor. X-ray diffraction （XRD）, X-ray fluorescence spectroscopy （XRF）, ion chro- matography （IC） and thermal decomposition were used to determine the carbonation conversion. The influences of various factors, including reaction temperature, reaction pressure, solution composition, heat-treatment and particle size, were dis- cussed. Concurrently, the effects of SO2 and NO presented in simulated flue gas were also investigated and a possible mecha- nism was used to explain the results. Experimental results show that reaction temperature, reaction pressure and particle size can effectively improve the carbonation reaction. Addition of 0.6 M NaHCO3 was also proved to be beneficial to the reaction and heat-treatment is not needed for wollastonite to get a higher carbonation conversion. Compared with carbonation in puri- fied CO2 gas, CO2 sequestration directly from simulated flue gas by mineral carbonation is suggested to have a certain degree of economic feasibility in the conditions of medium and low-pressure. A highest carbonation conversion of 35.9% is gained on the condition of T=150℃, P=40 bar and PS 〈30 μ in distilled water for 1 h.
