The rock series, rock types and Sr Nd isotopic dating of the Cenozoic volcanic rocks in the South China Sea are similar to those in its vicinity. On the basis of the spreading age of the South China Sea, the Cenozoic ...The rock series, rock types and Sr Nd isotopic dating of the Cenozoic volcanic rocks in the South China Sea are similar to those in its vicinity. On the basis of the spreading age of the South China Sea, the Cenozoic volcanic rocks are divided into three stages: the pre spreading stage, the spreading stage and the post spreading stage. The deep process characteristics of the asthenosphere and lithosphere may be inferred from the study on primary basaltic magma. The top layers of the asthenosphere both in the spreading stage and in the pre spreading stage are closer to the earth surface than that in the post spreading stage. From the pre spreading stage to the spreading stage, the top layer of the asthenosphere decreased in depth, while the amount of interstitial partial melts increased. The evolution of the primary basaltic magma shows a progressive evolution sequence of the rifting volcanism and a faster lithospheric spreading velocity. From the spreading stage to the post spreading stage, the top layer of the asthenosphere gradually increased in depth, but the amount of interstitial partial melts decreased. The evolution of primary basaltic magma shows a retrogressive evolution sequence of the rifting volcanism and a gradual decrease in the lithospheric spreading velocity. The depth recognized by the study on the Cenozoic volcanism demonstrates the deep environment for the formation and evolution of the South China Sea.展开更多
Based on the latest result in research on 3D seismic wave velocity structure of crust and uppermost mantle and taking geological setting and fracture zones into consideration, a 3D geological model for the studied reg...Based on the latest result in research on 3D seismic wave velocity structure of crust and uppermost mantle and taking geological setting and fracture zones into consideration, a 3D geological model for the studied region is built up. The boundary constraint and force loading boundary condition for the model are determined according to the characteristics of crustal stress field deduced from earthquake focal mechanism and in-situ stress measurement data. Using linear elastic material model a 3D finite element modeling is conducted to study the characteristics of crustal stress field. A comparison analysis between the simulated stress field and earthquake locations reveals that the moderate and strong earthquakes generally occurred in the zones with high shear stress gradient. Furthermore, the paper notices a few potential earthquake-prone regions.展开更多
In order to unify the time and the space attributes into temporal-spatial distance, the temporal-spatial proportional coefficient fTS is proposed in this paper. In accordance with the new distance concept, the tempora...In order to unify the time and the space attributes into temporal-spatial distance, the temporal-spatial proportional coefficient fTS is proposed in this paper. In accordance with the new distance concept, the temporal-spatial correlativity within temporal doublets of strong earthquakes in North China and its vicinity since AD 1500 has been analyzed. The computation results indicate that doublets of strong earthquake can be divided into two groups when fTS is endowed with 10 km/a in the new distance formula. The temporal-spatial distance between two points of doublet generally cannot exceed 140 km when two strong quakes in doublet have some causative relation. And those doublets with temporal-spatial distance exceeding 280 km are probably independent seismic events in doublets. This character can be the reference to the migration law summarization and trend prediction.展开更多
Controlled by E-W-trending faults, a Proterozoic (1.4-1.8 Ga old) rapakivi granite suite was intruded inBeijing and the area to its east (within Hebei Province), forming three parallel belts of igneous rocks. Theisoto...Controlled by E-W-trending faults, a Proterozoic (1.4-1.8 Ga old) rapakivi granite suite was intruded inBeijing and the area to its east (within Hebei Province), forming three parallel belts of igneous rocks. Theisotopic, trace element and rare earth element geochemical data of a bimodal rock association made up ofanorthosite, gabbro and alkali basalt and olivine-bearing quartz-syenite, rapakivi granite and trachyte as wellas potassic A-type granites and anorogenic granites—— all suggest that there exists an incipient rift in thestudy area. Fractional crystallization of a mixed magma formed by the magma derived from the upper mantleand the magma derived by small degrees of fusion of the lower crust produced anorthosite cumulates. Thewater-deficient granitic magma was differentiated into a subalkaline series. When the fractional crystallizationwas incomplete, rhythmic eruptions took place.展开更多
In order to construct a newly developed green area, the Tanggu urban area as the core part of Binhai new area,needs more and more clean energy year by year. This area is abound in geothermal resources endowed by the g...In order to construct a newly developed green area, the Tanggu urban area as the core part of Binhai new area,needs more and more clean energy year by year. This area is abound in geothermal resources endowed by the grand Nature.Based on the estimation of展开更多
In this paper the asymptotic solutions of the reduced wave equation (1) in the vicinity of a higher caustic have been found out by means of asymptotic expansions of the generalized Airy function, and the order (or the...In this paper the asymptotic solutions of the reduced wave equation (1) in the vicinity of a higher caustic have been found out by means of asymptotic expansions of the generalized Airy function, and the order (or the singularity inder) and the phase's increment of solutions on the higher caustic have been obtained, too.展开更多
Based on the horizontal velocity data observed by GPS during 2004-2007,2007-2009,and 2011-2017 before,during,and after the Wenchuan earthquake in Sichuan-Yunnan and its vicinity,we analyze evolution features of the te...Based on the horizontal velocity data observed by GPS during 2004-2007,2007-2009,and 2011-2017 before,during,and after the Wenchuan earthquake in Sichuan-Yunnan and its vicinity,we analyze evolution features of the tectonic deformation caused by crustal movement in main active fault belts,and its possible influence.We conclude:the Wenchuan earthquake area showed obvious co-seismic thrust and dextral deformation from 2007 to 2009.The earthquake,to a certain extent,promoted tectonic movements on the Gansu-Sichuan boundary,Western Qinling fault zone,Anninghe-Zemuhe fault zone,and southern Xianshuihe fault zone.The vectors and strain filed acquired by GPS during Lushan and Jiuzhaigou earthquakes period may indicate that the southwest segment in the Longmenshan fault zone still has the possibility of larger earthquakes.展开更多
First,we devise in this paper,a multi-regions discrete-time model which describes the spatial-temporal spread of an epidemic which starts from one region and enters to regions which are connected with their neighbors ...First,we devise in this paper,a multi-regions discrete-time model which describes the spatial-temporal spread of an epidemic which starts from one region and enters to regions which are connected with their neighbors by any kind of anthropological movement.We suppose homogeneous Susceptible-Infected-Removed(SIR)populations,and we consider in our simulations,a grid of colored cells,which represents the whole domain affected by the epidemic while each cell can represent a sub-domain or region.Second,in order to minimize the number of infected individuals in one region,we propose an optimal control approach based on a travel-blocking vicinity strategy which aims to control only one cell by restricting movements of infected people coming from all neighboring cells.Thus,we show the influence of the optimal control approach on the controlled cell.We should also note that the cellular modeling approach we propose here,can also describes infection dynamics of regions which are not necessarily attached one to an other,even if no empty space can be viewed between cells.The theoretical method we follow for the characterization of the travel-locking optimal controls,is based on a discrete version of Pontryagin's maximum principle while the numerical approach applied to the multi-points boundary value problems we obtain here,is based on discrete progressive-regressive iterative schemes.We illustrate our modeling and control approaches by giving an example of 100 regions.展开更多
Rising sea level is of great significance to coastal societies;predicting sea level extent in coastal regions is critical.When carrying out predictions,the subsequences obtained using decomposition methods may exhibit...Rising sea level is of great significance to coastal societies;predicting sea level extent in coastal regions is critical.When carrying out predictions,the subsequences obtained using decomposition methods may exhibit a certain regularity and therefore can provide multidimensional information that can be used to improve prediction models.Traditional decomposition methods such as seasonal and trend decomposition using Loess(STL)focus mostly on the fluctuating trend of time series and ignore its impact on prediction.Methods in the signal decomposition domain,such as variational mode decomposition(VMD),have no physical significance.In response to the above problems,a new decomposition method for sea level anomaly time series prediction(DMSLAP)is proposed.With this method,the trend term in a time series can be isolated and the effects of abnormal sea level change behaviors can be attenuated.We decompose multiperiod characteristics using this method while maintaining the smoothness of the analyzed series.Satellite altimetry data from 1993 to 2020 are used in experiments conducted in the study area.The results are then compared with predictions obtained using existing decomposition methods such as the STL and VMD methods and time varying filtering based on empirical mode decomposition(TVF-EMD).The performance of DMSLAP combined with a prediction method resulted in optimal sea level anomaly(SLA)predictions,with a minimum root mean square error(RMSE)of 1.40 cm and a maximum determination coefficient(R^(2))of 0.93 during 2020.The DMSLAP method was more accurate when predicting 1-year data and 3-year data.The TVF-EMD and DMSLAP methods had comparable accuracies,and the periodic term decomposed by the DMSLAP method was more in line with the actual law than that derived using the TVF-EMD method.Thus,DMSLAP can decompose SLA time series better than existing methods and is an effective tool for obtaining short-term SLA prediction.展开更多
We investigate the effects of strain on the electronic and magnetic properties of ReS2 monolayer with sulfur vacancies using density functional theory.Unstrained ReS2 monolayer with monosulfur vacancy(Vs) and disulf...We investigate the effects of strain on the electronic and magnetic properties of ReS2 monolayer with sulfur vacancies using density functional theory.Unstrained ReS2 monolayer with monosulfur vacancy(Vs) and disulfur vacancy(V(2S))both are nonmagnetic.However,as strain increases to 8%,VS-doped ReS2 monolayer appears a magnetic half-metal behavior with zero total magnetic moment.In particular,for V(2S)-doped ReS2 monolayer,the system becomes a magnetic semiconductor under 6%strain,in which Re atoms at vicinity of vacancy couple anti-ferromagnetically with each other,and continues to show a ferromagnetic metal characteristic with total magnetic moment of 1.60μb under 7%strain.Our results imply that the strain-manipulated ReS2 monolayer with VS and V(2S) can be a possible candidate for new spintronic applications.展开更多
One of the core issues in modern celestial mechanics is the orbital dynamics in the near-regime gravitational field of as- teroids, which provides deep insights into the mathematical nature of a class of nonlinear sys...One of the core issues in modern celestial mechanics is the orbital dynamics in the near-regime gravitational field of as- teroids, which provides deep insights into the mathematical nature of a class of nonlinear systems, and plays as a critical basis for in situ explorations of different science goals. Lots of efforts have been made to reveal the characteristics of orbital motion in the vicinity of asteroids, and to improve the skills of asteroid research in methodology.展开更多
The attenuation coefficient of the impressed first sound due to the scattering of random background of the second sound is calculated.The result shows that this is an important factor which gives rise the attenuation ...The attenuation coefficient of the impressed first sound due to the scattering of random background of the second sound is calculated.The result shows that this is an important factor which gives rise the attenuation of the first sound in the vicinity of transition temperature T_(λ) at very high frequencies of GHz range.The predicted value agrees with the measured data in order of magnitude.展开更多
西方人的恐惧可谓五花八门,据美国2001年4月2日的《时代周刊》报导,在英语中由-phobia(恐惧)为后缀的有500多个单词,而且非常难记,都是由一个拉丁词根加-phobia 构成的。例如,文章中形容了一位中年女子,她最怕的东西就是电:“Get her in...西方人的恐惧可谓五花八门,据美国2001年4月2日的《时代周刊》报导,在英语中由-phobia(恐惧)为后缀的有500多个单词,而且非常难记,都是由一个拉丁词根加-phobia 构成的。例如,文章中形容了一位中年女子,她最怕的东西就是电:“Get her in the vicinity of an appliance of a展开更多
Otamixaban is a potent (Ki=0.5 nM) fXa inhibitor currently in late-stage clinical develop-ment at Sanofi for the management of acute coronary syndrome. Being unproductive in obtaining a suitable crystal of Otamixaba...Otamixaban is a potent (Ki=0.5 nM) fXa inhibitor currently in late-stage clinical develop-ment at Sanofi for the management of acute coronary syndrome. Being unproductive in obtaining a suitable crystal of Otamixaban, the required enantiomeric characterization has been accomplished using vibrational circular dichroism (VCD) spectroscopy. Selected by a spectrum similarity index, the calculated spectra of several higher energy conformers were found to match well with the observed spectra. The characteristic IR bands of these conformers were also identified and attributed to the solvation effect. Combined with both the single crystal x-ray diffraction results for an intermediate and the proton NMR study, the absolute configuration of Otamixaban is unambiguously determined to be (R,R).展开更多
Selective oxidation of glycerol provides a feasible route towards the sustainable synthesis of high value-added chemicals.Herein,the hydroxyapatite(HAP)supported palladium(Pd)species were fabricated by impregnation an...Selective oxidation of glycerol provides a feasible route towards the sustainable synthesis of high value-added chemicals.Herein,the hydroxyapatite(HAP)supported palladium(Pd)species were fabricated by impregnation and subsequent calcination.The as-obtained heterogeneous Pd catalyst afforded not only excellent selectivity to glyceric acid(GLA)up to 90%with 59%conversion of glycerol but also good recyclability by using molecular oxygen as an oxidant under mild conditions.The characterization of catalysts indicated that both the surface basicity and Pd sites on the catalyst played a crucial role in promoting glycerol oxidation.Notably,it demonstrated that the presence of the vicinal hydroxyl group of glycerol molecule can assist the oxidation reaction via forming a coordination between the vicinal hydroxyl group and Ca^(2+) sites on HAP-derived catalysts.In this catalytic process,the secondary hydroxyl of glycerol kept untouched and the primary hydroxyl of glycerol was converted into carboxyl group,while the Pd species acted as active centers for cooperatively promoting the subsequent oxidation to generate GLA.Additionally,this catalytic system can be extended widely for the oxidative conversion of other vicinal diols into the corresponding a-hydroxycarboxylic acids selectively.Isotope labeling experiment using H_(2)^(18)O confirmed that H_(2)O not only acted as solvent but also was involved in the catalytic cycles.On the basis of the results,a possible reaction mechanism has been proposed.The HAP-supported Pd catalytic system has been shown to serve as an effective approach for the upgrading of bio-derived vicinal diols to high value-added chemicals.展开更多
Enantiopure vicinal diols are important building blocks used in the synthesis of fine chemicals and pharmaceutical compounds. Diol dehydrogenase(DDH) mediated stereoselective oxidation of racemic vicinal is an efficie...Enantiopure vicinal diols are important building blocks used in the synthesis of fine chemicals and pharmaceutical compounds. Diol dehydrogenase(DDH) mediated stereoselective oxidation of racemic vicinal is an efficient way to prepare enantiopure vicinal diols. In this study, four new bacterial DDHs(AnDDH from Anoxybacillus sp. P3 H1 B, HcDDH from Hazenella coriacea, GzDDH from Geobacillus zalihae and LwDDH from Leptotrichia wadei) were mined from the GenBank database and expressed in E. coli T7.The four DDHs were purified and biochemically characterized for oxidation activity toward(R)-1-phenyl-1,2-ethanediol, with the optimal reaction condition of pH9.0(AnDDH), 10.0(HcDDH) and 11.0(GzDDH and LwDDH) and the temperatures at 40 ℃(AnDDH), 50 ℃(HcDDH) and 60 ℃(GzDDH and LwDDH), respectively. The four enzymes were stable at the pH from 7.0 to 9.0 and below 40 ℃.Kinetic parameters of four DDHs showed that the HcDDH from Hazenella coriacea had high activity toward a broad range of vicinal diols. A series of racemic vicinal diols were successfully resolved by recombinant E. coli(HcDDH-NOX) resting cells co-expression of an NADH oxidase(NOX), affording(S)-diols and(1 S, 2 S)-trans-diols in ≥99% ee. The synthetic potential of HcDDH was proved by E. coli(HcDDH-NOX) via kinetic resolution of racemic trans-1,2-indandiol on a 100 ml scale reaction,(S, S)-trans-1,2-indandiol was prepared in 46.7% yield and >99% ee. In addition, asymmetric reduction of four α-Hydroxy ketones(10–300 mmol·L^(-1)) by E. coli(HcDDH-GDH) resting cells resulted in >99% ee and69–98% yields of(R)-vicinal diols. The current research expands the toolbox of DDHs to synthesize chiral vicinal diols and demonstrated that the mined Hc DDH is a potential enzyme in the synthesis of a broad range of chiral vicinal diols.展开更多
A1GaN/GaN heterostructures on vicinal sapphire substrates and just-oriented sapphire substrates (0001) are grown by the metalorganic chemical vapor deposition method. Samples are studied by high-resolution x-ray dif...A1GaN/GaN heterostructures on vicinal sapphire substrates and just-oriented sapphire substrates (0001) are grown by the metalorganic chemical vapor deposition method. Samples are studied by high-resolution x-ray diffraction, atomic force microscopy, capacitance-voltage measurement and the Van der Panw Hall-effect technique. The investigation reveals that better crystal quality and surface morphology of the sample are obtained on the vicinal substrate. Fur- thermore, the electrical properties are also improved when the sample is grown on the vicinal substrate. This is due to the fact that the use of vicinal substrate can promote the step-flow mode of crystal growth, so many macro-steps are formed during crystal growth, which causes a reduction of threading dislocations in the crystal and an improvement in the electrical properties of the AlGaN/GaN heterostructure.展开更多
A novel strategy was developed for the asymmetric synthesis of fluorinated vicinal diamines.Deprotonation of N-(diphenylmethylene)-benzylamines under base,followed by asymmetric nucleophilic addition to N-tert-butanes...A novel strategy was developed for the asymmetric synthesis of fluorinated vicinal diamines.Deprotonation of N-(diphenylmethylene)-benzylamines under base,followed by asymmetric nucleophilic addition to N-tert-butanesulfinylfluoroacetaldimines,a pair of diastereomeric isomers were afforded.The diastereomeric isomers can be easily separated from each other by silica gel column chromatography.The absolute steric configuration of two isomers was confirmed by single crystal X-ray diffraction analyses.The proposed mechanism revealed that the configuration of the carbon next to tert-butanesulfinyl was well controlled to be R by the chiral auxiliary.展开更多
文摘The rock series, rock types and Sr Nd isotopic dating of the Cenozoic volcanic rocks in the South China Sea are similar to those in its vicinity. On the basis of the spreading age of the South China Sea, the Cenozoic volcanic rocks are divided into three stages: the pre spreading stage, the spreading stage and the post spreading stage. The deep process characteristics of the asthenosphere and lithosphere may be inferred from the study on primary basaltic magma. The top layers of the asthenosphere both in the spreading stage and in the pre spreading stage are closer to the earth surface than that in the post spreading stage. From the pre spreading stage to the spreading stage, the top layer of the asthenosphere decreased in depth, while the amount of interstitial partial melts increased. The evolution of the primary basaltic magma shows a progressive evolution sequence of the rifting volcanism and a faster lithospheric spreading velocity. From the spreading stage to the post spreading stage, the top layer of the asthenosphere gradually increased in depth, but the amount of interstitial partial melts decreased. The evolution of primary basaltic magma shows a retrogressive evolution sequence of the rifting volcanism and a gradual decrease in the lithospheric spreading velocity. The depth recognized by the study on the Cenozoic volcanism demonstrates the deep environment for the formation and evolution of the South China Sea.
基金China Natural Science Foundation (49674220, 49734015) and Open Laboratory Project of Dynamic Geodesy, Chinese Academy of Science
文摘Based on the latest result in research on 3D seismic wave velocity structure of crust and uppermost mantle and taking geological setting and fracture zones into consideration, a 3D geological model for the studied region is built up. The boundary constraint and force loading boundary condition for the model are determined according to the characteristics of crustal stress field deduced from earthquake focal mechanism and in-situ stress measurement data. Using linear elastic material model a 3D finite element modeling is conducted to study the characteristics of crustal stress field. A comparison analysis between the simulated stress field and earthquake locations reveals that the moderate and strong earthquakes generally occurred in the zones with high shear stress gradient. Furthermore, the paper notices a few potential earthquake-prone regions.
基金Innovation Foundation of Chinese Academy of Sciences
文摘In order to unify the time and the space attributes into temporal-spatial distance, the temporal-spatial proportional coefficient fTS is proposed in this paper. In accordance with the new distance concept, the temporal-spatial correlativity within temporal doublets of strong earthquakes in North China and its vicinity since AD 1500 has been analyzed. The computation results indicate that doublets of strong earthquake can be divided into two groups when fTS is endowed with 10 km/a in the new distance formula. The temporal-spatial distance between two points of doublet generally cannot exceed 140 km when two strong quakes in doublet have some causative relation. And those doublets with temporal-spatial distance exceeding 280 km are probably independent seismic events in doublets. This character can be the reference to the migration law summarization and trend prediction.
文摘Controlled by E-W-trending faults, a Proterozoic (1.4-1.8 Ga old) rapakivi granite suite was intruded inBeijing and the area to its east (within Hebei Province), forming three parallel belts of igneous rocks. Theisotopic, trace element and rare earth element geochemical data of a bimodal rock association made up ofanorthosite, gabbro and alkali basalt and olivine-bearing quartz-syenite, rapakivi granite and trachyte as wellas potassic A-type granites and anorogenic granites—— all suggest that there exists an incipient rift in thestudy area. Fractional crystallization of a mixed magma formed by the magma derived from the upper mantleand the magma derived by small degrees of fusion of the lower crust produced anorthosite cumulates. Thewater-deficient granitic magma was differentiated into a subalkaline series. When the fractional crystallizationwas incomplete, rhythmic eruptions took place.
文摘In order to construct a newly developed green area, the Tanggu urban area as the core part of Binhai new area,needs more and more clean energy year by year. This area is abound in geothermal resources endowed by the grand Nature.Based on the estimation of
文摘In this paper the asymptotic solutions of the reduced wave equation (1) in the vicinity of a higher caustic have been found out by means of asymptotic expansions of the generalized Airy function, and the order (or the singularity inder) and the phase's increment of solutions on the higher caustic have been obtained, too.
基金supported by Earthquake Tracking Project of China Earthquake Administration(2021020509)National Natural Science Foundation of China(41802229)Science for Earthquake Resilience(XH20080Y)
文摘Based on the horizontal velocity data observed by GPS during 2004-2007,2007-2009,and 2011-2017 before,during,and after the Wenchuan earthquake in Sichuan-Yunnan and its vicinity,we analyze evolution features of the tectonic deformation caused by crustal movement in main active fault belts,and its possible influence.We conclude:the Wenchuan earthquake area showed obvious co-seismic thrust and dextral deformation from 2007 to 2009.The earthquake,to a certain extent,promoted tectonic movements on the Gansu-Sichuan boundary,Western Qinling fault zone,Anninghe-Zemuhe fault zone,and southern Xianshuihe fault zone.The vectors and strain filed acquired by GPS during Lushan and Jiuzhaigou earthquakes period may indicate that the southwest segment in the Longmenshan fault zone still has the possibility of larger earthquakes.
基金This work is supported by the Systems Theory Network(Reseau Theorie des Systemes),and Hassan II Academy of Sciences and Technologies-Morocco.
文摘First,we devise in this paper,a multi-regions discrete-time model which describes the spatial-temporal spread of an epidemic which starts from one region and enters to regions which are connected with their neighbors by any kind of anthropological movement.We suppose homogeneous Susceptible-Infected-Removed(SIR)populations,and we consider in our simulations,a grid of colored cells,which represents the whole domain affected by the epidemic while each cell can represent a sub-domain or region.Second,in order to minimize the number of infected individuals in one region,we propose an optimal control approach based on a travel-blocking vicinity strategy which aims to control only one cell by restricting movements of infected people coming from all neighboring cells.Thus,we show the influence of the optimal control approach on the controlled cell.We should also note that the cellular modeling approach we propose here,can also describes infection dynamics of regions which are not necessarily attached one to an other,even if no empty space can be viewed between cells.The theoretical method we follow for the characterization of the travel-locking optimal controls,is based on a discrete version of Pontryagin's maximum principle while the numerical approach applied to the multi-points boundary value problems we obtain here,is based on discrete progressive-regressive iterative schemes.We illustrate our modeling and control approaches by giving an example of 100 regions.
基金Supported by the Fundamental Research Funds for the Central Universities (No.17CX02071)the National Natural Science Foundation of China (No.61571009)the Key R&D Program of Shandong Province (No.2018GHY115046)。
文摘Rising sea level is of great significance to coastal societies;predicting sea level extent in coastal regions is critical.When carrying out predictions,the subsequences obtained using decomposition methods may exhibit a certain regularity and therefore can provide multidimensional information that can be used to improve prediction models.Traditional decomposition methods such as seasonal and trend decomposition using Loess(STL)focus mostly on the fluctuating trend of time series and ignore its impact on prediction.Methods in the signal decomposition domain,such as variational mode decomposition(VMD),have no physical significance.In response to the above problems,a new decomposition method for sea level anomaly time series prediction(DMSLAP)is proposed.With this method,the trend term in a time series can be isolated and the effects of abnormal sea level change behaviors can be attenuated.We decompose multiperiod characteristics using this method while maintaining the smoothness of the analyzed series.Satellite altimetry data from 1993 to 2020 are used in experiments conducted in the study area.The results are then compared with predictions obtained using existing decomposition methods such as the STL and VMD methods and time varying filtering based on empirical mode decomposition(TVF-EMD).The performance of DMSLAP combined with a prediction method resulted in optimal sea level anomaly(SLA)predictions,with a minimum root mean square error(RMSE)of 1.40 cm and a maximum determination coefficient(R^(2))of 0.93 during 2020.The DMSLAP method was more accurate when predicting 1-year data and 3-year data.The TVF-EMD and DMSLAP methods had comparable accuracies,and the periodic term decomposed by the DMSLAP method was more in line with the actual law than that derived using the TVF-EMD method.Thus,DMSLAP can decompose SLA time series better than existing methods and is an effective tool for obtaining short-term SLA prediction.
基金Project supported by the National Natural Science Foundation of China(Grant No.11547030)
文摘We investigate the effects of strain on the electronic and magnetic properties of ReS2 monolayer with sulfur vacancies using density functional theory.Unstrained ReS2 monolayer with monosulfur vacancy(Vs) and disulfur vacancy(V(2S))both are nonmagnetic.However,as strain increases to 8%,VS-doped ReS2 monolayer appears a magnetic half-metal behavior with zero total magnetic moment.In particular,for V(2S)-doped ReS2 monolayer,the system becomes a magnetic semiconductor under 6%strain,in which Re atoms at vicinity of vacancy couple anti-ferromagnetically with each other,and continues to show a ferromagnetic metal characteristic with total magnetic moment of 1.60μb under 7%strain.Our results imply that the strain-manipulated ReS2 monolayer with VS and V(2S) can be a possible candidate for new spintronic applications.
文摘One of the core issues in modern celestial mechanics is the orbital dynamics in the near-regime gravitational field of as- teroids, which provides deep insights into the mathematical nature of a class of nonlinear systems, and plays as a critical basis for in situ explorations of different science goals. Lots of efforts have been made to reveal the characteristics of orbital motion in the vicinity of asteroids, and to improve the skills of asteroid research in methodology.
文摘The attenuation coefficient of the impressed first sound due to the scattering of random background of the second sound is calculated.The result shows that this is an important factor which gives rise the attenuation of the first sound in the vicinity of transition temperature T_(λ) at very high frequencies of GHz range.The predicted value agrees with the measured data in order of magnitude.
文摘西方人的恐惧可谓五花八门,据美国2001年4月2日的《时代周刊》报导,在英语中由-phobia(恐惧)为后缀的有500多个单词,而且非常难记,都是由一个拉丁词根加-phobia 构成的。例如,文章中形容了一位中年女子,她最怕的东西就是电:“Get her in the vicinity of an appliance of a
文摘Otamixaban is a potent (Ki=0.5 nM) fXa inhibitor currently in late-stage clinical develop-ment at Sanofi for the management of acute coronary syndrome. Being unproductive in obtaining a suitable crystal of Otamixaban, the required enantiomeric characterization has been accomplished using vibrational circular dichroism (VCD) spectroscopy. Selected by a spectrum similarity index, the calculated spectra of several higher energy conformers were found to match well with the observed spectra. The characteristic IR bands of these conformers were also identified and attributed to the solvation effect. Combined with both the single crystal x-ray diffraction results for an intermediate and the proton NMR study, the absolute configuration of Otamixaban is unambiguously determined to be (R,R).
基金support from the National Natural Science Foundation of China(21773061,21978095)Innovation Program of Shanghai Municipal Education Commission(15ZZ031)the Fundamental Research Funds for the Central Universities。
文摘Selective oxidation of glycerol provides a feasible route towards the sustainable synthesis of high value-added chemicals.Herein,the hydroxyapatite(HAP)supported palladium(Pd)species were fabricated by impregnation and subsequent calcination.The as-obtained heterogeneous Pd catalyst afforded not only excellent selectivity to glyceric acid(GLA)up to 90%with 59%conversion of glycerol but also good recyclability by using molecular oxygen as an oxidant under mild conditions.The characterization of catalysts indicated that both the surface basicity and Pd sites on the catalyst played a crucial role in promoting glycerol oxidation.Notably,it demonstrated that the presence of the vicinal hydroxyl group of glycerol molecule can assist the oxidation reaction via forming a coordination between the vicinal hydroxyl group and Ca^(2+) sites on HAP-derived catalysts.In this catalytic process,the secondary hydroxyl of glycerol kept untouched and the primary hydroxyl of glycerol was converted into carboxyl group,while the Pd species acted as active centers for cooperatively promoting the subsequent oxidation to generate GLA.Additionally,this catalytic system can be extended widely for the oxidative conversion of other vicinal diols into the corresponding a-hydroxycarboxylic acids selectively.Isotope labeling experiment using H_(2)^(18)O confirmed that H_(2)O not only acted as solvent but also was involved in the catalytic cycles.On the basis of the results,a possible reaction mechanism has been proposed.The HAP-supported Pd catalytic system has been shown to serve as an effective approach for the upgrading of bio-derived vicinal diols to high value-added chemicals.
基金supported by the National Natural Science Foundation of China(Grant No.21772141)the Shanxi Province Science Foundation for Youths(grant No.201701D221042)the Key Research and Development(R&D)Project of Shanxi Province(201803D31050).
文摘Enantiopure vicinal diols are important building blocks used in the synthesis of fine chemicals and pharmaceutical compounds. Diol dehydrogenase(DDH) mediated stereoselective oxidation of racemic vicinal is an efficient way to prepare enantiopure vicinal diols. In this study, four new bacterial DDHs(AnDDH from Anoxybacillus sp. P3 H1 B, HcDDH from Hazenella coriacea, GzDDH from Geobacillus zalihae and LwDDH from Leptotrichia wadei) were mined from the GenBank database and expressed in E. coli T7.The four DDHs were purified and biochemically characterized for oxidation activity toward(R)-1-phenyl-1,2-ethanediol, with the optimal reaction condition of pH9.0(AnDDH), 10.0(HcDDH) and 11.0(GzDDH and LwDDH) and the temperatures at 40 ℃(AnDDH), 50 ℃(HcDDH) and 60 ℃(GzDDH and LwDDH), respectively. The four enzymes were stable at the pH from 7.0 to 9.0 and below 40 ℃.Kinetic parameters of four DDHs showed that the HcDDH from Hazenella coriacea had high activity toward a broad range of vicinal diols. A series of racemic vicinal diols were successfully resolved by recombinant E. coli(HcDDH-NOX) resting cells co-expression of an NADH oxidase(NOX), affording(S)-diols and(1 S, 2 S)-trans-diols in ≥99% ee. The synthetic potential of HcDDH was proved by E. coli(HcDDH-NOX) via kinetic resolution of racemic trans-1,2-indandiol on a 100 ml scale reaction,(S, S)-trans-1,2-indandiol was prepared in 46.7% yield and >99% ee. In addition, asymmetric reduction of four α-Hydroxy ketones(10–300 mmol·L^(-1)) by E. coli(HcDDH-GDH) resting cells resulted in >99% ee and69–98% yields of(R)-vicinal diols. The current research expands the toolbox of DDHs to synthesize chiral vicinal diols and demonstrated that the mined Hc DDH is a potential enzyme in the synthesis of a broad range of chiral vicinal diols.
基金Project supported by the State Key Program of National Natural Science Foundation of China (Grant No 60736033)the National Key Science and Technology Special Project (Grant No 2008ZX 0101002-003)
文摘A1GaN/GaN heterostructures on vicinal sapphire substrates and just-oriented sapphire substrates (0001) are grown by the metalorganic chemical vapor deposition method. Samples are studied by high-resolution x-ray diffraction, atomic force microscopy, capacitance-voltage measurement and the Van der Panw Hall-effect technique. The investigation reveals that better crystal quality and surface morphology of the sample are obtained on the vicinal substrate. Fur- thermore, the electrical properties are also improved when the sample is grown on the vicinal substrate. This is due to the fact that the use of vicinal substrate can promote the step-flow mode of crystal growth, so many macro-steps are formed during crystal growth, which causes a reduction of threading dislocations in the crystal and an improvement in the electrical properties of the AlGaN/GaN heterostructure.
基金the Innovation Program of Shanghai Municipal Education Commission,China(No.13ZZ047)the Fundamental Research Funds for the Central Universities,China(No.2232015D3-13)
文摘A novel strategy was developed for the asymmetric synthesis of fluorinated vicinal diamines.Deprotonation of N-(diphenylmethylene)-benzylamines under base,followed by asymmetric nucleophilic addition to N-tert-butanesulfinylfluoroacetaldimines,a pair of diastereomeric isomers were afforded.The diastereomeric isomers can be easily separated from each other by silica gel column chromatography.The absolute steric configuration of two isomers was confirmed by single crystal X-ray diffraction analyses.The proposed mechanism revealed that the configuration of the carbon next to tert-butanesulfinyl was well controlled to be R by the chiral auxiliary.