In order to understand the mechanism and regularity of the groundwater contamination from mine water of abandoned mines, experiments were conducted on an abandoned coal mine in Fuxin, a representative city with lots o...In order to understand the mechanism and regularity of the groundwater contamination from mine water of abandoned mines, experiments were conducted on an abandoned coal mine in Fuxin, a representative city with lots of mine water in northeast China. The groundwater pollution from different contaminants of coal-mining voids （total hardness, SO4^2-, CI^- and total Fe） and pollution factors transportation situation in the coal rock were simulated by soil column experiment under the conditions of mine water leaching and main water leaching （similar to rainwater leaching）, and the water-rock interaction mechanism was discussed during mine water infiltration through saturated coal rock by application of principle of mass conservation, based on physical properties of coal rock, as well as monitored chemical composition. The results show that, compared with the clear water leaching process, trends of change in pollutant concentrations presented different characteristics in the mine water leaching process. Groundwater is contaminated by the water rock interactions such as migration ＆ accumulation, adsorption ＆ transformation, dissolution ＆ desorption and ion exchange during the mine water permeation. The experiments also suggest that at first dissolution rate of some kinds of dissoluble salts is high, but it decreases with leaching time, even to zero during both the mine water leaching and main water leaching.展开更多
Agricultural tridimensional pollution （AtriP） has multi-directional and complicated chains. Circular economy is found to be an efficient mechanism that can help control AtriP. The application of three circular econo...Agricultural tridimensional pollution （AtriP） has multi-directional and complicated chains. Circular economy is found to be an efficient mechanism that can help control AtriP. The application of three circular economic modes in agriculture and its related industries call not only interdict the AtriP chains in different stages and different directions, but also produce greater ecological, social and economical returns with less input. Nevertheless, it is a complicated systematic engineering to construct and implement effective circular economic modes to bring AtriP under control, and it depends not only on the support of the relevant technology system, but also on the supports of the relevant policies and law systems.展开更多
The mechanisms of adsorption of pesticides（dimethoate, metalaxyl, atrazine, malathion and prometryn） and heavy metals（Cu, Cd, Pb, Zn and Ni） coexisting in sediments, with pesticides as target pollutants, and the i...The mechanisms of adsorption of pesticides（dimethoate, metalaxyl, atrazine, malathion and prometryn） and heavy metals（Cu, Cd, Pb, Zn and Ni） coexisting in sediments, with pesticides as target pollutants, and the influence of their main effects and double-order interaction effects were studied using the experimental design module in the Minitab software package with a 2^10-3 fractional factorial design method at resolution V. The main, double-order interaction, synergistic and antagonistic effect values of pollutant concentrations influencing the adsorption of pesticides were set as dependent variables, while various quantum chemical parameters of pesticides were set as independent variables, and two-dimensional quantitative structure activity relationship（2D-QSAR） models were established by stepwise regression to reveal the adsorption mechanisms of pesticides in a composite contamination system. The main effects of pollutants concentration played the primary role in the adsorption of dimethoate and malathion（the rates of contributions were 53.54% and 56.46%, respectively）, while double-order interaction effects were primarily responsible for metalaxyl, atrazine and prometryn adsorption（the rates of contributions were 79.05%, 60.21% and 57.89%, respectively） in the pesticide/heavy metals coexisting sediment system. The synergistic effects of the main effects and double-order interaction effects of pollutants concentration（synergistic effects） played a leading role in adsorption of malathion and prometryn（the rates of contributions were 70.61% and 69.61%, respectively）, while an- tagonistic effects of the main effects and double-order interaction effects of pollutants（antagonistic effects） played a dominant role in the adsorption of dimethoate, metalaxyl and atrazine（the rates of contributions were 58.82%, 56.89% and 58.24%, respectively）. Moreover, the correlation coefficient value（R2） ranged from 0.986 to 0.999（〉0.8783） in the 2D-QSAR model, while the standard deviation（SD） ranged from 0.006 to 0.066 and the Ftest values were 22.684-199.544, indicating the model has good predictive ability and fit. The 2D-QSAR model revealed a significant correlation（P=0.05） between the main effects of pollutants concentrations on pesticides adsorption（main effect values） and the most positive hydrogen atomic charge（qa＋）, the highest occupied molecular orbital energy（EHOMO） and the dipole moment（μ）. Furthermore, double-order interaction effect values of pollutant concentrations influenced the adsorption of pesticides（double-order interaction effect values）, and the most positive atomic charge（q＋）, qH＋, and the lowest unoccupied molecular orbital energy（ELMO） were significantly correlated. The qw, EHOMO and μ of pesticides were found to be significant factors promoting pesticides adsorption, while the q＋ and ELVMO of pesticides were significant inhibiting factors（P=0,05）. Overall, this study provides a theoretical basis for further realization of combined pollution control of pesticide pollutants in complex environmental systems.展开更多
基金the National Natural Science Foundation of China(50434020,50374042)Science & Technology Found of Liaoning Province(20022155)Specialized Research Fund for the Doctoral Program of Higher Education(20040147003)
文摘In order to understand the mechanism and regularity of the groundwater contamination from mine water of abandoned mines, experiments were conducted on an abandoned coal mine in Fuxin, a representative city with lots of mine water in northeast China. The groundwater pollution from different contaminants of coal-mining voids （total hardness, SO4^2-, CI^- and total Fe） and pollution factors transportation situation in the coal rock were simulated by soil column experiment under the conditions of mine water leaching and main water leaching （similar to rainwater leaching）, and the water-rock interaction mechanism was discussed during mine water infiltration through saturated coal rock by application of principle of mass conservation, based on physical properties of coal rock, as well as monitored chemical composition. The results show that, compared with the clear water leaching process, trends of change in pollutant concentrations presented different characteristics in the mine water leaching process. Groundwater is contaminated by the water rock interactions such as migration ＆ accumulation, adsorption ＆ transformation, dissolution ＆ desorption and ion exchange during the mine water permeation. The experiments also suggest that at first dissolution rate of some kinds of dissoluble salts is high, but it decreases with leaching time, even to zero during both the mine water leaching and main water leaching.
文摘Agricultural tridimensional pollution （AtriP） has multi-directional and complicated chains. Circular economy is found to be an efficient mechanism that can help control AtriP. The application of three circular economic modes in agriculture and its related industries call not only interdict the AtriP chains in different stages and different directions, but also produce greater ecological, social and economical returns with less input. Nevertheless, it is a complicated systematic engineering to construct and implement effective circular economic modes to bring AtriP under control, and it depends not only on the support of the relevant technology system, but also on the supports of the relevant policies and law systems.
文摘The mechanisms of adsorption of pesticides（dimethoate, metalaxyl, atrazine, malathion and prometryn） and heavy metals（Cu, Cd, Pb, Zn and Ni） coexisting in sediments, with pesticides as target pollutants, and the influence of their main effects and double-order interaction effects were studied using the experimental design module in the Minitab software package with a 2^10-3 fractional factorial design method at resolution V. The main, double-order interaction, synergistic and antagonistic effect values of pollutant concentrations influencing the adsorption of pesticides were set as dependent variables, while various quantum chemical parameters of pesticides were set as independent variables, and two-dimensional quantitative structure activity relationship（2D-QSAR） models were established by stepwise regression to reveal the adsorption mechanisms of pesticides in a composite contamination system. The main effects of pollutants concentration played the primary role in the adsorption of dimethoate and malathion（the rates of contributions were 53.54% and 56.46%, respectively）, while double-order interaction effects were primarily responsible for metalaxyl, atrazine and prometryn adsorption（the rates of contributions were 79.05%, 60.21% and 57.89%, respectively） in the pesticide/heavy metals coexisting sediment system. The synergistic effects of the main effects and double-order interaction effects of pollutants concentration（synergistic effects） played a leading role in adsorption of malathion and prometryn（the rates of contributions were 70.61% and 69.61%, respectively）, while an- tagonistic effects of the main effects and double-order interaction effects of pollutants（antagonistic effects） played a dominant role in the adsorption of dimethoate, metalaxyl and atrazine（the rates of contributions were 58.82%, 56.89% and 58.24%, respectively）. Moreover, the correlation coefficient value（R2） ranged from 0.986 to 0.999（〉0.8783） in the 2D-QSAR model, while the standard deviation（SD） ranged from 0.006 to 0.066 and the Ftest values were 22.684-199.544, indicating the model has good predictive ability and fit. The 2D-QSAR model revealed a significant correlation（P=0.05） between the main effects of pollutants concentrations on pesticides adsorption（main effect values） and the most positive hydrogen atomic charge（qa＋）, the highest occupied molecular orbital energy（EHOMO） and the dipole moment（μ）. Furthermore, double-order interaction effect values of pollutant concentrations influenced the adsorption of pesticides（double-order interaction effect values）, and the most positive atomic charge（q＋）, qH＋, and the lowest unoccupied molecular orbital energy（ELMO） were significantly correlated. The qw, EHOMO and μ of pesticides were found to be significant factors promoting pesticides adsorption, while the q＋ and ELVMO of pesticides were significant inhibiting factors（P=0,05）. Overall, this study provides a theoretical basis for further realization of combined pollution control of pesticide pollutants in complex environmental systems.
