The geometric structures of an Nit radical in different external electric fields are optimized by using the density functional B3P86/cc-PVSZ method, and the bond lengths, dipole moments, vibration frequencies and IR s...The geometric structures of an Nit radical in different external electric fields are optimized by using the density functional B3P86/cc-PVSZ method, and the bond lengths, dipole moments, vibration frequencies and IR spectrum are obtained. The potential energy curves are gained by the CCSD (T) method with the same basis set. These results indicate that the physical property parameters and potential energy curves may change with the external electric field, especially in the reverse direction electric field. The potential energy function of zero field is fitted by the Morse potential, and the fitting parameters are in good accordance with the experimental data. The potential energy functions of different external electric fields are fitted adopting the constructed potential model. The fitted critical dissociation electric parameters are shown to be consistent with the numerical calculation, and the relative errors are only 0.27% and 6.61%, hence the constructed model is reliable and accurate. The present results provide an important reference for further study of the molecular spectrum, dynamics and molecular cooling with Stark effect.展开更多
The data from regional geology, boreholes, geophysics and tests are integrated to analyze the fluid dynamic field in the Bozhong depression, Bohai Bay basin. The current geothermal gradient is determined to be about ...The data from regional geology, boreholes, geophysics and tests are integrated to analyze the fluid dynamic field in the Bozhong depression, Bohai Bay basin. The current geothermal gradient is determined to be about 2.95 /100 m by integrating 266 drill-stem test (DST) measurements and comparing with the global average value. The paleogeothermal gradients are calculated from the homogenization temperatures of saline inclusions, which vary both laterally and vertically. The data from sonic logs, well tests and seismic velocities are used to investigate the pressure variations in the study area. The mudstone compaction is classified as three major types: normal compaction and normal pressure, under-compaction and overpressure, and past-compaction and under-overpressure. The current pressure profile is characterized by normal pressure, sight pressure and intense overpressure from top to bottom The faults, unconformity surfaces and interconnecting pores constitute a complex network of vertical and horizontal fluid flows within the depression. The fluid potential energy profiles present a 'double-deck' structure. The depocenters are the area of fluids supply, whereas the slopes and uplifts are the main areas of fluids charge.展开更多
The Fourier equation explains the dynamics of heat transfer. But bringing this phenomenon closer to the notion of fibration seems difficult to achieve. This study then aims to find the solution of the one-dimensional ...The Fourier equation explains the dynamics of heat transfer. But bringing this phenomenon closer to the notion of fibration seems difficult to achieve. This study then aims to find the solution of the one-dimensional Fourier equation and to interpret it in terms of bundle. And then apply the results obtained at the Kankule site in Katana in South Kivu. To do this work, we resorted to geometric or topological analysis of the Hopf<span><span><span style="font-family:;" "=""> </span></span></span><span><span><span style="font-family:;" "=""><span style="font-family:Verdana;">fibration of the unit sphere</span><i> </i></span></span></span><span><span><i><span style="font-family:Verdana;">S</span></i></span></span><span><span><sup><span style="font-family:Verdana;">3</span></sup><span style="font-family:Verdana;"> </span></span></span><span><span><span style="font-family:;" "=""> </span></span></span><span><span><span style="font-family:Verdana;">(identifiable in </span><span style="font-family:Verdana;"><i></i></span></span></span><i><span><span><i><span style="font-family:Verdana;">S</span></i></span></span></i><i><span><span><i><span style="font-family:Verdana;">U</span></i></span></span></i><span style="font-family:Verdana;"><span style="font-family:Verdana;"><span style="font-family:Verdana;">(2)). We had taken the temperatures of the thermal waters and the soil of Kankule, from 2010 to 2</span></span></span><span style="font-family:Verdana;"><span style="font-family:Verdana;"><span style="font-family:Verdana;">0</span></span></span><span><span><span style="font-family:;" "=""><span style="font-family:Verdana;">14, </span><i><span style="font-family:Verdana;">in situ</span></i><span style="font-family:Verdana;">. And laboratory analy</span></span></span></span><span style="font-family:Verdana;"><span style="font-family:Verdana;"><span style="font-family:Verdana;">s</span></span></span><span style="font-family:Verdana;"><span style="font-family:Verdana;"><span style="font-family:Verdana;">es had allowed us to know the physical and chemical properties of the soil and water at each of our 14 study sites in Kankule. The data of the geomagnetic field of each site, were taken in on the site NOAA, for our period of study. We then determined the integral curve (geotherm) of the Fourier equation and wrote it as a unit quaternion which is a bundle. The constants intervened in the geotherm, for each site of Kankule, we had obtained them statistically. We have found that the geotherm of each Kankule site is a bundle. We have compared this model to the bundle model of the geomagnetic field. From there we realized that to determine the energy potential of Kankule, we should consider the thermal springs separately. We were able to find a connection between the fibration of the geomagnetic field and the heat field for the Kankule site.</span></span></span>展开更多
基金Supported by the National Natural Science Foundation of China under Grant Nos 11147158 and 11264020the Jiangxi Province Natural Science Foundation under Grant No 2010GQW0031the Jiangxi Province Scientific Research Program of the Education Bureau under Grant No GJJ12483
文摘The geometric structures of an Nit radical in different external electric fields are optimized by using the density functional B3P86/cc-PVSZ method, and the bond lengths, dipole moments, vibration frequencies and IR spectrum are obtained. The potential energy curves are gained by the CCSD (T) method with the same basis set. These results indicate that the physical property parameters and potential energy curves may change with the external electric field, especially in the reverse direction electric field. The potential energy function of zero field is fitted by the Morse potential, and the fitting parameters are in good accordance with the experimental data. The potential energy functions of different external electric fields are fitted adopting the constructed potential model. The fitted critical dissociation electric parameters are shown to be consistent with the numerical calculation, and the relative errors are only 0.27% and 6.61%, hence the constructed model is reliable and accurate. The present results provide an important reference for further study of the molecular spectrum, dynamics and molecular cooling with Stark effect.
基金he Foundation for University KeyTeacher by the Ministry of Education, China (GG-170-10491-1460).
文摘The data from regional geology, boreholes, geophysics and tests are integrated to analyze the fluid dynamic field in the Bozhong depression, Bohai Bay basin. The current geothermal gradient is determined to be about 2.95 /100 m by integrating 266 drill-stem test (DST) measurements and comparing with the global average value. The paleogeothermal gradients are calculated from the homogenization temperatures of saline inclusions, which vary both laterally and vertically. The data from sonic logs, well tests and seismic velocities are used to investigate the pressure variations in the study area. The mudstone compaction is classified as three major types: normal compaction and normal pressure, under-compaction and overpressure, and past-compaction and under-overpressure. The current pressure profile is characterized by normal pressure, sight pressure and intense overpressure from top to bottom The faults, unconformity surfaces and interconnecting pores constitute a complex network of vertical and horizontal fluid flows within the depression. The fluid potential energy profiles present a 'double-deck' structure. The depocenters are the area of fluids supply, whereas the slopes and uplifts are the main areas of fluids charge.
文摘The Fourier equation explains the dynamics of heat transfer. But bringing this phenomenon closer to the notion of fibration seems difficult to achieve. This study then aims to find the solution of the one-dimensional Fourier equation and to interpret it in terms of bundle. And then apply the results obtained at the Kankule site in Katana in South Kivu. To do this work, we resorted to geometric or topological analysis of the Hopf<span><span><span style="font-family:;" "=""> </span></span></span><span><span><span style="font-family:;" "=""><span style="font-family:Verdana;">fibration of the unit sphere</span><i> </i></span></span></span><span><span><i><span style="font-family:Verdana;">S</span></i></span></span><span><span><sup><span style="font-family:Verdana;">3</span></sup><span style="font-family:Verdana;"> </span></span></span><span><span><span style="font-family:;" "=""> </span></span></span><span><span><span style="font-family:Verdana;">(identifiable in </span><span style="font-family:Verdana;"><i></i></span></span></span><i><span><span><i><span style="font-family:Verdana;">S</span></i></span></span></i><i><span><span><i><span style="font-family:Verdana;">U</span></i></span></span></i><span style="font-family:Verdana;"><span style="font-family:Verdana;"><span style="font-family:Verdana;">(2)). We had taken the temperatures of the thermal waters and the soil of Kankule, from 2010 to 2</span></span></span><span style="font-family:Verdana;"><span style="font-family:Verdana;"><span style="font-family:Verdana;">0</span></span></span><span><span><span style="font-family:;" "=""><span style="font-family:Verdana;">14, </span><i><span style="font-family:Verdana;">in situ</span></i><span style="font-family:Verdana;">. And laboratory analy</span></span></span></span><span style="font-family:Verdana;"><span style="font-family:Verdana;"><span style="font-family:Verdana;">s</span></span></span><span style="font-family:Verdana;"><span style="font-family:Verdana;"><span style="font-family:Verdana;">es had allowed us to know the physical and chemical properties of the soil and water at each of our 14 study sites in Kankule. The data of the geomagnetic field of each site, were taken in on the site NOAA, for our period of study. We then determined the integral curve (geotherm) of the Fourier equation and wrote it as a unit quaternion which is a bundle. The constants intervened in the geotherm, for each site of Kankule, we had obtained them statistically. We have found that the geotherm of each Kankule site is a bundle. We have compared this model to the bundle model of the geomagnetic field. From there we realized that to determine the energy potential of Kankule, we should consider the thermal springs separately. We were able to find a connection between the fibration of the geomagnetic field and the heat field for the Kankule site.</span></span></span>