The crystal structure, morphology, dissolution kinetics and mechanism of gibbsitic bauxite and pure gibbsite in Na OH solution under atmospheric pressure were systematically investigated by XRD and SEM. The results sh...The crystal structure, morphology, dissolution kinetics and mechanism of gibbsitic bauxite and pure gibbsite in Na OH solution under atmospheric pressure were systematically investigated by XRD and SEM. The results show that the size of single crystal of gibbsite in gibbsitic bauxite is smaller than that in pure gibbsite, but the interplanar distance is larger than that of pure gibbsite, which result in more defects in the crystal and less energy needed to dissolve in alkaline solution for the gibbsitic bauxite. The dissolution kinetic equations of gibbsitic bauxite and pure gibbsite were established, and the corresponding activation energies were calculated to be 99.144 and 115.149 k J/mol, respectively.展开更多
X-ray diffraction(XRD) and crystal structure analysis were used to study the effects of Mg content and cooling rate on the titanium phase transformation of three types of titanium slag. The results indicate that in ...X-ray diffraction(XRD) and crystal structure analysis were used to study the effects of Mg content and cooling rate on the titanium phase transformation of three types of titanium slag. The results indicate that in the rapid cooling process, the titanium phase is anosovite, whose chemical formula is MgnTi(3-n)O5(0n1). In the slow cooling process, when the Mg content is high, anosovite transforms into karrooite MgTi2O5 structure; when the Mg content is low, karrooite MgTi2O5 and rutile TiO2 both exist. The stability of karrooite MgTi2O5 is better than that of anosovite MgnTi(3-n)O5. Slow cooling contributes to the doping of Mg into the anosovite crystal and stabilises the anosovite crystal structure.展开更多
Various conditions were investigated in detail for the novel organic template-free static hydrothermal synthesis of SUZ-4 zeolite in the presence of seeds. The obtained samples were characterized by XRD (X-ray diffra...Various conditions were investigated in detail for the novel organic template-free static hydrothermal synthesis of SUZ-4 zeolite in the presence of seeds. The obtained samples were characterized by XRD (X-ray diffraction), SEM (scanning electron microscope), TG (thermal gravimetric analysis), ICP (inductively coupling plasma) elemental analysis, nitrogen sorption isotherm and surface area. The results show that pure SUZ-4 zeolites with high crystallinity are obtained in a broad window of synthesis conditions: seed mass concentration 0.2%-2%, SIO2/A1203 molar ratio 21 25, KOH/SiO2 molar ratio 0.33 0.43, H20/SiO2 molar ratio 7.14-38.1, aging time 24 h, crystallization temperature 160℃, and crystallization time 6-10 d. Also, crystallinity and size of the rod-like SUZ-4 zeolite crystals are found to alter with the conditions.展开更多
Owing to its photonic band gap(PBG)and slow light effects,aniline black(AB)-poly(vinylidene fluoride)(PVDF)inverse opal(IO)photonic crystal(PC)was constructed to promote the utility of light and realize photothermal s...Owing to its photonic band gap(PBG)and slow light effects,aniline black(AB)-poly(vinylidene fluoride)(PVDF)inverse opal(IO)photonic crystal(PC)was constructed to promote the utility of light and realize photothermal synergetic catalysis.As a highly efficient reaction platform with the capability of restricting heat,a microreactor was introduced to further amplify the photothermal effects of near infrared(NIR)radiation.The photocatalytic efficiency of ZnO/0.5AB-PVDF IO(Z0.5A)increases 1.63-fold compared to that of pure ZnO film under a full solar spectrum,indicating the effectiveness of synergetic promotion by slow light and photothermal effects.Moreover,a 5.85-fold increase is achieved by combining Z0.5A with a microreactor compared to the film in a beaker.The photon localization effect of PVDF IO was further exemplified by finite-difference time-domain(FDTD)calculations.In conclusion,photonic crystal-microreactor enhanced photothermal catalysis has immense potential for alleviating the deteriorating water environment.展开更多
Interface is the key issue to understand the performance of composite materials.In this work,we study the interface between octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine(HMX) and graphite,try to find out its contri...Interface is the key issue to understand the performance of composite materials.In this work,we study the interface between octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine(HMX) and graphite,try to find out its contribution to mixture explosives.The work starts from the force-field derivation.We get ab initio based pair potentials across the interface,and then use them to study the interface structural and mechanical properties.A series of large scale molecular dynamics simulations are performed.The structure evolution,energy variation and elastic/plastic transformation of interface and polycrystal systems are calculated.The desensitizing mechanism of graphite to HMX is discussed.展开更多
The single crystals of the title compound NH4+C4H5O6- (C4H9NO6, Mr = 167.1) were obtained from a hot aqueous solution containing L-glutamine and D,L-tartaric acid in mole ratio1:1.5. The crystal belongs to monoclinic ...The single crystals of the title compound NH4+C4H5O6- (C4H9NO6, Mr = 167.1) were obtained from a hot aqueous solution containing L-glutamine and D,L-tartaric acid in mole ratio1:1.5. The crystal belongs to monoclinic space group P21/c with a = 7.646(2), b = 7.804(2), c = 11.502(3)? ?= 102.26(2)o, V = 670.7(3)?, Z = 4, F(000) = 352, Dc = 1.655 g.cm-3, m(MoKa) = 0.16 mm-1, R = 0.035, wR = 0.094 for 1028 observed reflections (I>2s(I)). The enatiomeric anions of the tartrate with both (2S,3S)- and (2R,3R)-configuration co-exist in the unit cell. The carbon skeleton assumes a coplanar arrangement with a torsion angle of 181.5o. The three- dimensional H-bonding network exists in the crystal. While tartrate groups link each other by H-bonds between carboxyl and hydroxyl groups, the ammonium cations insert between the tartrate groups to form a sandwich-like crystal structure.展开更多
A magnetic field was used to directional solidification of dendritic Al-Cu alloys. The primary arm spacing of the dendrites is increased with increasing the external magnetic field strength. This microstructural coars...A magnetic field was used to directional solidification of dendritic Al-Cu alloys. The primary arm spacing of the dendrites is increased with increasing the external magnetic field strength. This microstructural coarsening is related to the thermoelectric current on the l/s interface, which is induced by difference of temperature on the inter- face. Within a magnetic field Lorentz force may be generated in front of the interface, causing a thermoelectric-magneto convection that makes the microstructure coarsened. This induced convection also leads to structural instability so that the secondary arms are well developed when grown in the external field.展开更多
The most remarkable effect in spinel ferrites is the strong dependence of properties on the state of structural disorder and,in particular,on the cation distribution.The structural characterization of a Co-Zn ferrite ...The most remarkable effect in spinel ferrites is the strong dependence of properties on the state of structural disorder and,in particular,on the cation distribution.The structural characterization of a Co-Zn ferrite nanoparticle sample was reported which prepared by wet chemical co-precipitation method.The samples were sintered at three different temperatures viz.650℃,850℃ and 1050℃ for 12 h.The structural details like:lattice constant and distribution of cations in the tetrahedral and octahedral interstitial voids have been deduced through X-ray diffraction (XRD) data analysis.Lattice constant was found to increase with the increase in Zn2+ ions and sintering temperature.Theoretical intensity ratios of (220),(400),(440) planes were considered,as these reflections are sensitive to cations on the A and B sites.Close agreement of the theoretical intensity ratio with the intensity ratio observed from XRD pattern supports the occupancy of Zn2+ ions and Co2+ ions on the octahedral and tetrahedral sites,respectively.展开更多
RS-3-chloro-2-oxy-propyltrimethylammonium-chloride 1, an important inter- mediate of carnitine and acetylcholine, has been synthesized and resolved by using R,R-tartric acid. Di-(S-3-chloro-2-oxy-propyltrimethylammoni...RS-3-chloro-2-oxy-propyltrimethylammonium-chloride 1, an important inter- mediate of carnitine and acetylcholine, has been synthesized and resolved by using R,R-tartric acid. Di-(S-3-chloro-2-oxy-propyltrimethylammonium)-R,R-tartrate 2, with optical purity of 81.76%, has been obtained. Compound 2 was characterized by IR spectroscopy, MS, NMR and X-ray diffrac- tion, and it crystallizes in orthorhombic, space group P212121, absolute structure parameter 0.56(8), with cell parameters a = 8.323(2), b = 10.203(2), c = 26.178(5) ? C16H34Cl2N2O8, Mr = 453.272, V = 2223.0(8) ?, Z = 4, Dc = 1.354 g/cm3, m = 0.335 mm-1, F(000) = 968, R = 0.0534 and wR = 0.1274 for 4376 observed reflections (I > 2s(I)). The lattice is composed of two S-3-chloro- 2-oxy-propyltrimethylammonium cations and one R,R-tartrate dianion which are arranged in separate stacks linked via hydrogen bonds.展开更多
We report the fabrication of a highly sensitive field-effect transistor (FET) biosensor using thermally-reduced graphene oxide (TRGO) sheets functionalized with gold nanoparticle (NP)-antibody conjugates. Probe ...We report the fabrication of a highly sensitive field-effect transistor (FET) biosensor using thermally-reduced graphene oxide (TRGO) sheets functionalized with gold nanoparticle (NP)-antibody conjugates. Probe antibody was labeled on the surface of TRGO sheets through Au NPs and electrical detection of protein binding (Immunoglobulin G/IgG and anti-lmmunoglobulin G/anti-lgG) was accomplished by FET and direct current (dc) measurements. The protein binding events induced significant changes in the resistance of the TRGO sheet, which is referred to as the sensor response. The dependence of the sensor response on the TRGO base resistance in the sensor and the antibody areal density on the TRGO sheet was systematically studied, from which a correlation of the sensor response with sensor parameters was found: the sensor response was more significant with larger TRGO base resistance and higher antibody areal density. The detection limit of the novel biosensor was around the 0.2 ng/rnL level, which is among the best of,'eported carbon nanomaterial-based protein sensors and can be further optimized by tuning the sensor structure.展开更多
基金Projects(5110404151174054+2 种基金51374065)supported by the National Natural Science Foundation of ChinaProject(N130402010)supported by the Fundamental Research Funds for the Central UniversitiesChina
文摘The crystal structure, morphology, dissolution kinetics and mechanism of gibbsitic bauxite and pure gibbsite in Na OH solution under atmospheric pressure were systematically investigated by XRD and SEM. The results show that the size of single crystal of gibbsite in gibbsitic bauxite is smaller than that in pure gibbsite, but the interplanar distance is larger than that of pure gibbsite, which result in more defects in the crystal and less energy needed to dissolve in alkaline solution for the gibbsitic bauxite. The dissolution kinetic equations of gibbsitic bauxite and pure gibbsite were established, and the corresponding activation energies were calculated to be 99.144 and 115.149 k J/mol, respectively.
基金Project(51090385)supported by the National Natural Science Foundation of China
文摘X-ray diffraction(XRD) and crystal structure analysis were used to study the effects of Mg content and cooling rate on the titanium phase transformation of three types of titanium slag. The results indicate that in the rapid cooling process, the titanium phase is anosovite, whose chemical formula is MgnTi(3-n)O5(0n1). In the slow cooling process, when the Mg content is high, anosovite transforms into karrooite MgTi2O5 structure; when the Mg content is low, karrooite MgTi2O5 and rutile TiO2 both exist. The stability of karrooite MgTi2O5 is better than that of anosovite MgnTi(3-n)O5. Slow cooling contributes to the doping of Mg into the anosovite crystal and stabilises the anosovite crystal structure.
基金Supported by the National Natural Science Foundation of China(20976084,21101094,21136005)
文摘Various conditions were investigated in detail for the novel organic template-free static hydrothermal synthesis of SUZ-4 zeolite in the presence of seeds. The obtained samples were characterized by XRD (X-ray diffraction), SEM (scanning electron microscope), TG (thermal gravimetric analysis), ICP (inductively coupling plasma) elemental analysis, nitrogen sorption isotherm and surface area. The results show that pure SUZ-4 zeolites with high crystallinity are obtained in a broad window of synthesis conditions: seed mass concentration 0.2%-2%, SIO2/A1203 molar ratio 21 25, KOH/SiO2 molar ratio 0.33 0.43, H20/SiO2 molar ratio 7.14-38.1, aging time 24 h, crystallization temperature 160℃, and crystallization time 6-10 d. Also, crystallinity and size of the rod-like SUZ-4 zeolite crystals are found to alter with the conditions.
文摘Owing to its photonic band gap(PBG)and slow light effects,aniline black(AB)-poly(vinylidene fluoride)(PVDF)inverse opal(IO)photonic crystal(PC)was constructed to promote the utility of light and realize photothermal synergetic catalysis.As a highly efficient reaction platform with the capability of restricting heat,a microreactor was introduced to further amplify the photothermal effects of near infrared(NIR)radiation.The photocatalytic efficiency of ZnO/0.5AB-PVDF IO(Z0.5A)increases 1.63-fold compared to that of pure ZnO film under a full solar spectrum,indicating the effectiveness of synergetic promotion by slow light and photothermal effects.Moreover,a 5.85-fold increase is achieved by combining Z0.5A with a microreactor compared to the film in a beaker.The photon localization effect of PVDF IO was further exemplified by finite-difference time-domain(FDTD)calculations.In conclusion,photonic crystal-microreactor enhanced photothermal catalysis has immense potential for alleviating the deteriorating water environment.
基金Supported by the 973 Project in China under Grant No. 61383National Natural Science Foundation of China under Grant No. 11004011+1 种基金Defence Industrial Technology Development Program under Grant No. B1520110002Open Project of State Key Labo-ratory of Explosion Science and Technology (Beijing Institute of Technology,No. KFJJ11-2M)
文摘Interface is the key issue to understand the performance of composite materials.In this work,we study the interface between octahydro-1,3,5,7-tetranitro-1,3,5,7-tetrazocine(HMX) and graphite,try to find out its contribution to mixture explosives.The work starts from the force-field derivation.We get ab initio based pair potentials across the interface,and then use them to study the interface structural and mechanical properties.A series of large scale molecular dynamics simulations are performed.The structure evolution,energy variation and elastic/plastic transformation of interface and polycrystal systems are calculated.The desensitizing mechanism of graphite to HMX is discussed.
文摘The single crystals of the title compound NH4+C4H5O6- (C4H9NO6, Mr = 167.1) were obtained from a hot aqueous solution containing L-glutamine and D,L-tartaric acid in mole ratio1:1.5. The crystal belongs to monoclinic space group P21/c with a = 7.646(2), b = 7.804(2), c = 11.502(3)? ?= 102.26(2)o, V = 670.7(3)?, Z = 4, F(000) = 352, Dc = 1.655 g.cm-3, m(MoKa) = 0.16 mm-1, R = 0.035, wR = 0.094 for 1028 observed reflections (I>2s(I)). The enatiomeric anions of the tartrate with both (2S,3S)- and (2R,3R)-configuration co-exist in the unit cell. The carbon skeleton assumes a coplanar arrangement with a torsion angle of 181.5o. The three- dimensional H-bonding network exists in the crystal. While tartrate groups link each other by H-bonds between carboxyl and hydroxyl groups, the ammonium cations insert between the tartrate groups to form a sandwich-like crystal structure.
基金Supported by LTU Foundations of Science and Technology
文摘A magnetic field was used to directional solidification of dendritic Al-Cu alloys. The primary arm spacing of the dendrites is increased with increasing the external magnetic field strength. This microstructural coarsening is related to the thermoelectric current on the l/s interface, which is induced by difference of temperature on the inter- face. Within a magnetic field Lorentz force may be generated in front of the interface, causing a thermoelectric-magneto convection that makes the microstructure coarsened. This induced convection also leads to structural instability so that the secondary arms are well developed when grown in the external field.
文摘The most remarkable effect in spinel ferrites is the strong dependence of properties on the state of structural disorder and,in particular,on the cation distribution.The structural characterization of a Co-Zn ferrite nanoparticle sample was reported which prepared by wet chemical co-precipitation method.The samples were sintered at three different temperatures viz.650℃,850℃ and 1050℃ for 12 h.The structural details like:lattice constant and distribution of cations in the tetrahedral and octahedral interstitial voids have been deduced through X-ray diffraction (XRD) data analysis.Lattice constant was found to increase with the increase in Zn2+ ions and sintering temperature.Theoretical intensity ratios of (220),(400),(440) planes were considered,as these reflections are sensitive to cations on the A and B sites.Close agreement of the theoretical intensity ratio with the intensity ratio observed from XRD pattern supports the occupancy of Zn2+ ions and Co2+ ions on the octahedral and tetrahedral sites,respectively.
文摘RS-3-chloro-2-oxy-propyltrimethylammonium-chloride 1, an important inter- mediate of carnitine and acetylcholine, has been synthesized and resolved by using R,R-tartric acid. Di-(S-3-chloro-2-oxy-propyltrimethylammonium)-R,R-tartrate 2, with optical purity of 81.76%, has been obtained. Compound 2 was characterized by IR spectroscopy, MS, NMR and X-ray diffrac- tion, and it crystallizes in orthorhombic, space group P212121, absolute structure parameter 0.56(8), with cell parameters a = 8.323(2), b = 10.203(2), c = 26.178(5) ? C16H34Cl2N2O8, Mr = 453.272, V = 2223.0(8) ?, Z = 4, Dc = 1.354 g/cm3, m = 0.335 mm-1, F(000) = 968, R = 0.0534 and wR = 0.1274 for 4376 observed reflections (I > 2s(I)). The lattice is composed of two S-3-chloro- 2-oxy-propyltrimethylammonium cations and one R,R-tartrate dianion which are arranged in separate stacks linked via hydrogen bonds.
基金Financial support for this work was provided by the USA National Science Foundation (NSF) (Nos. CMMI- 0900509, CBET-0803142, and ECCS-0708998). Graphene oxide samples were supplied by Prof. Rodney S. Ruoff. The authors thank Dr. Heather A. Owen for technical support with SEM, and Dr. Leonidas E. Ocola for assistance in the electrode fabrication. The e-beam lithography was performed at the Center for Nanoscale Materials of Argonne National Laboratory, which is supported by the USA Department of Energy (No. DE- AC02-06CH11357). The SEM imaging was conducted at the Electron Microscope Laboratory of University of Wisconsin-Milwaukee.
文摘We report the fabrication of a highly sensitive field-effect transistor (FET) biosensor using thermally-reduced graphene oxide (TRGO) sheets functionalized with gold nanoparticle (NP)-antibody conjugates. Probe antibody was labeled on the surface of TRGO sheets through Au NPs and electrical detection of protein binding (Immunoglobulin G/IgG and anti-lmmunoglobulin G/anti-lgG) was accomplished by FET and direct current (dc) measurements. The protein binding events induced significant changes in the resistance of the TRGO sheet, which is referred to as the sensor response. The dependence of the sensor response on the TRGO base resistance in the sensor and the antibody areal density on the TRGO sheet was systematically studied, from which a correlation of the sensor response with sensor parameters was found: the sensor response was more significant with larger TRGO base resistance and higher antibody areal density. The detection limit of the novel biosensor was around the 0.2 ng/rnL level, which is among the best of,'eported carbon nanomaterial-based protein sensors and can be further optimized by tuning the sensor structure.