Two new transition-metal coordination polymers,{[Cd(oba)(L)_(2)]·H_(2)O}_n(1)and[Cd(4-nph)(L)_(2)]_n(2)(H_(2)oba=4,4'-oxydibenzoic acid,4-H_(2)nph=4-nitrophthalic acid,L=2,2'-biimidazole),were successfull...Two new transition-metal coordination polymers,{[Cd(oba)(L)_(2)]·H_(2)O}_n(1)and[Cd(4-nph)(L)_(2)]_n(2)(H_(2)oba=4,4'-oxydibenzoic acid,4-H_(2)nph=4-nitrophthalic acid,L=2,2'-biimidazole),were successfully synthesized under hydrothermal conditions and characterized structurally by IR spectroscopy,elemental analyses,single-crystal X-ray diffraction,powder X-ray diffraction,and thermogravimetric analysis.The results of single-crystal X-ray diffraction show that complex 1 presents a 1D zigzag chain structure and further extends to a 2D network through N—H…O hydrogen bonds andπ-πstacking interactions.Meanwhile,complex 2 has a zero-dimensional structure and also extends to form a 2D network through N—H…O hydrogen bonds andπ-πstacking interactions.In addition,both 1and 2 exhibited luminescent properties in the solid state.Furthermore,quantum chemical calculations were carried out on the"molecular fragments"extracted from the crystal structures of 1 and 2 using the PBE0/LANL2DZ method constructed by the Gaussian 16 program.The calculated values signify a significant covalent interaction between the coordination atoms and the Cd(Ⅱ)ions.CCDC:2332173,1;2332176,2.展开更多
Two new coordination polymers,[Ni(Hpdc)(bib)(H_(2)O)]_(n)(1)and{[Ni(bib)_(3)](ClO_(4))_(2)}_(n)(2),were prepared by mixing Ni^(2+),3,5⁃pyrazoledicarboxylic acid(H3pdc)/p⁃nitrobenzoic acid and 1,4⁃bis(imidazol⁃1⁃ylmeth...Two new coordination polymers,[Ni(Hpdc)(bib)(H_(2)O)]_(n)(1)and{[Ni(bib)_(3)](ClO_(4))_(2)}_(n)(2),were prepared by mixing Ni^(2+),3,5⁃pyrazoledicarboxylic acid(H3pdc)/p⁃nitrobenzoic acid and 1,4⁃bis(imidazol⁃1⁃ylmethyl)butane(bib)by a hydrothermal method,respectively.X⁃ray crystallography reveals a 2D network constructed by six⁃coordinated Ni(Ⅱ)centers,bib,and Hpdc2-ligands in complex 1,while a 2D network is built by Ni(Ⅱ)and bib ligands in 2.Furthermore,the quantum⁃chemical calculations have been performed on‘molecular fragments’extracted from the crystal structure of 1 using the PBE0/LANL2DZ method in Gaussian 16 and the VASP program.CCDC:2343794,1;2343798,2.展开更多
The inhibition ability of 4-amino-5-phenyl-4H-1, 2, 4-trizole-3-thiol （APTT）, ethylenediaminetetra-acetic acid （EDTA） and thiourea （TU） for mild steel corrosion in 1.0 moFL HC1 solution at 30 ℃ was investigated...The inhibition ability of 4-amino-5-phenyl-4H-1, 2, 4-trizole-3-thiol （APTT）, ethylenediaminetetra-acetic acid （EDTA） and thiourea （TU） for mild steel corrosion in 1.0 moFL HC1 solution at 30 ℃ was investigated. Tafel polarization and electrochemical impedance spectroscopy （EIS） were used to investigate the influence of these organic compounds as corrosion inhibitors of mild steel in 1.0 mol/L HC1 solution at 30 ℃. The inhibition mechanism was discussed in terms of Langrnuir isotherm model. Results obtained from Tafel polarization and impedance measurements are in a good agreement. The inhibition efficiency increases with the increase of the inhibitor concentration. The adsorption of the inhibitors on the mild steel surface follows Langmuir adsorption isotherm and the free energy of adsorption AGads indicates that the adsorption of APTT, EDTA, and TU molecules is a spontaneous process and a typical chemisorption.展开更多
The effects of alkali oxides （Na2O and K2O addition on both the sintering behavior and dielectric properties of Ca-AI-B-Si-O glass/Al2O3 composites were investigated by Fourier transform infrared spectroscopy （FTIR...The effects of alkali oxides （Na2O and K2O addition on both the sintering behavior and dielectric properties of Ca-AI-B-Si-O glass/Al2O3 composites were investigated by Fourier transform infrared spectroscopy （FTIR）, differential scanning calorimeter （DSC）, X-ray diffractometry （XRD） and scanning electron microscopy （SEM）. The results show that the increasing amount of alkali oxides in the glass causes the decrease of [SiO4], which results in the decrease of the continuity of glass network, and leads to the decrease of the softening temperature Tf of the samples and the increasing trend of crystallization. And that deduces corresponding rise of densification, dielectric constant, dielectric loss of the low temperature co-fired ceramic （LTCC） materials and the decrease of its thermal conductivity. By contrast, the borosilicate glass/A1203 composites with 1.5% （mass fraction） alkali oxides sintered at 875 ℃ for 30 rain exhibit better properties of a bulk density of 2.79 g/cm3, a porosity of 0.48%, a 2 value of 2.28 W/（m.K）, a er value of 7.82 and a tand value of 9.1 × 10-4 （measured at 10 MHz）.展开更多
Using the mesophase pitch as precursor, KOH and CO2 as activated agents, the activated carbon electrode material was fabricated by physical-chemical combined activated technique for supercapacitor. The influence of ac...Using the mesophase pitch as precursor, KOH and CO2 as activated agents, the activated carbon electrode material was fabricated by physical-chemical combined activated technique for supercapacitor. The influence of activated process on the pore structure of activated carbon was analyzed and 14 F supercapacitor with working voltage of 2.5 V was prepared. The charge and discharge behaviors, the properties of cyclic voltammetry, specific capacitance, equivalent serials resistance （ESR）, cycle properties, and temperature properties of prepared supercapacitor were examined. The cyclic voltammetry curve results indicate that the carbon based supercapacitor using the self-made activated carbon as electrode materials shows the desired capacitance properties. In 1 mol/L Et4NBF4/AN electrolyte, the capacitance and ESR of the supercapacitor are 14.7 F and 60 mΩ respectively, The specific capacitance of activated carbon electrode materials is 99.6 F/g; its energy density can reach 2,96 W.h/kg under the large current discharge condition, There is no obvious capacitance decay that can be observed after 5000 cycles, The leakage current is below 0,2 mA after keeping the voltage at 2.5 V for l h, Meanwhile, the supercapacitor shows desired temperature property; it can be operated normally in the temperature ranging from -40 ℃to 70 ℃,展开更多
The effects of quality and content of fly ash on the early-age cracking behavior of high-flowing concrete （HFC） were investigated. The early-age cracking behavior of the HFC was analyzed by combining the tests of ev...The effects of quality and content of fly ash on the early-age cracking behavior of high-flowing concrete （HFC） were investigated. The early-age cracking behavior of the HFC was analyzed by combining the tests of evaporation capacity and electrical resistivity of the HFC. In these tests, a modified flat-type specimen was adopted. The results show that the HFC will have a lower evaporation capacity when it is mixed with fine fly ash, while it will have a higher evaporation capacity when grade II! fly ash is used as mineral admixture. And the electrical resistivity rate of HFC reduces with the increase of the content of fly ash. A nonlinear relationship exists between the cracking time of HFC and the minimum electrical resistivity. The early-age cracking behavior of HFC with fly ash can be enhanced by appropriately increasing the fine particle content and MgO, K2O, and SO3 contents of fly ash. The optimal content of fly ash, which makes a satisfied early-age cracking behavior of HFC, is obtained. And when the content of fly ash exceeds a critical value, the early-age cracking behavior of HFC will rapidly decrease.展开更多
A newly isolated bacterium was screened out for its survival on medium with 6 000 mg/L kraft lignin as the sole carbon source and energy, and identified as Pandoraea sp. by 16S rRNA gene sequence analysis. The biodegr...A newly isolated bacterium was screened out for its survival on medium with 6 000 mg/L kraft lignin as the sole carbon source and energy, and identified as Pandoraea sp. by 16S rRNA gene sequence analysis. The biodegradation experiment was carried out in mineral salt medium, containing 5 000 mg/L kraft lignin as only carbon and energy at pH 8.0 and 30℃. Under these conditions, significant reduction in color and lignin content by the strain was observed after incubation for 5 d. The strain attains maximum reduction capability in color （44.6%） and lignin content （39.9%） within 5 d of incubation, and reduced chemical oxygen demand（COD） from initial concentration 7 399 to 3 980 mg/L at maximum reduction level of 46.2% on the 4th day. The total ion chromatograph （TIC） of compounds presented in the chloroform extract of control and bacterial treated samples shows the formation of several lignin-related aromatic compounds including some small molecular lignin fragments, indicating a strong destruction in the lignin structure.展开更多
The oxidation behaviors of Ni-16Cr-xAl （x=4.5%, 9.0%, mass fraction） superalloy foams in air at 1000℃ were investigated. The effects of AI content on the resistance to high temperature oxidation were examined. The ...The oxidation behaviors of Ni-16Cr-xAl （x=4.5%, 9.0%, mass fraction） superalloy foams in air at 1000℃ were investigated. The effects of AI content on the resistance to high temperature oxidation were examined. The oxidation mechanisms of the foams were discussed. The results show that the resistance to the oxidation of the Ni-16Cr-xA1 based alloy at 1 000 ℃ increases with the content of A1 increasing from 4.5% to 9.0%. Complex oxide products are formed on the surface of the superalloy foams after the oxidation. Cr203 and A1203 are the predominant oxides for the scales of the foams with 4.5% A1 and 9% A1, respectively. Excellent high temperature oxidation resistance and superior pore conformation stability for the Ni-16Cr-xA1 based superalloy foam with 9% A1 can be mainly attributed to the formation of relatively continuous and protective A1203 oxides on the surface of the foam.展开更多
Microwave absorbing properties of high titanium slag were investigated by using microwave cavity perturbation technique. High titanium slag containing more than 90% TiO2 was prepared by carbothermal reduction of ilmen...Microwave absorbing properties of high titanium slag were investigated by using microwave cavity perturbation technique. High titanium slag containing more than 90% TiO2 was prepared by carbothermal reduction of ilmenite. The temperature rise curve of high titanium slag in microwave heating process was obtained. Crystalline compounds of high titanium slag before and after microwave irradiation were obtained and characterized by X-ray diffractometry （XRD）. Effects of particle size of high titanium slag anal mixtures of high titanium slag with different mass fractions of V2o5 on microwave absorbing properties were investigated systematically. The results show that high titanium slag has good microwave absorption property; untreated high titanium slag mainly consists of crystalline compounds of anatase and iron titanium oxide, while the microwave-irradiation treated one is mainly composed of crystalline compounds of rutile and irgn titanium oxide. Synthetic anatase is transformed completely into rutile at about 1 050 ℃ for 20 min under microwave irradiation. High frequency shift and low amplitude of voltage make high titanium slag an ideal microwave absorbent. 180 μm of particle size and 10% mass fraction of V2O5 are found to be the optimum conditions for microwave absorption.展开更多
The main objectives were to (1) calculate the total volatile organic compounds (TVOCs) inhalation dose, (2) analyze the proportions of human’s inhaled contaminant dose from different sources, and (3) present a newly ...The main objectives were to (1) calculate the total volatile organic compounds (TVOCs) inhalation dose, (2) analyze the proportions of human’s inhaled contaminant dose from different sources, and (3) present a newly defined ratio of relative inhalation dose level (RIDL) to assess indoor air quality (IAQ). A user defined function based on CFD (computational fluid dynamics) was developed, which integrated human motion model with TVOCs emission model in a high sidewall air supply ventilation mode. Based on simulation results of 10 cases, it is shown that the spatial concentration distribution of TVOCs is affected by human motion. TVOCs diffusion characteristic of building material is the most effective way to impact the TVOCs inhalation dose. From the RIDL index, case A-2 has the most serious IAQ problem, while case D-1 is of the best IAQ.展开更多
文摘Two new transition-metal coordination polymers,{[Cd(oba)(L)_(2)]·H_(2)O}_n(1)and[Cd(4-nph)(L)_(2)]_n(2)(H_(2)oba=4,4'-oxydibenzoic acid,4-H_(2)nph=4-nitrophthalic acid,L=2,2'-biimidazole),were successfully synthesized under hydrothermal conditions and characterized structurally by IR spectroscopy,elemental analyses,single-crystal X-ray diffraction,powder X-ray diffraction,and thermogravimetric analysis.The results of single-crystal X-ray diffraction show that complex 1 presents a 1D zigzag chain structure and further extends to a 2D network through N—H…O hydrogen bonds andπ-πstacking interactions.Meanwhile,complex 2 has a zero-dimensional structure and also extends to form a 2D network through N—H…O hydrogen bonds andπ-πstacking interactions.In addition,both 1and 2 exhibited luminescent properties in the solid state.Furthermore,quantum chemical calculations were carried out on the"molecular fragments"extracted from the crystal structures of 1 and 2 using the PBE0/LANL2DZ method constructed by the Gaussian 16 program.The calculated values signify a significant covalent interaction between the coordination atoms and the Cd(Ⅱ)ions.CCDC:2332173,1;2332176,2.
文摘Two new coordination polymers,[Ni(Hpdc)(bib)(H_(2)O)]_(n)(1)and{[Ni(bib)_(3)](ClO_(4))_(2)}_(n)(2),were prepared by mixing Ni^(2+),3,5⁃pyrazoledicarboxylic acid(H3pdc)/p⁃nitrobenzoic acid and 1,4⁃bis(imidazol⁃1⁃ylmethyl)butane(bib)by a hydrothermal method,respectively.X⁃ray crystallography reveals a 2D network constructed by six⁃coordinated Ni(Ⅱ)centers,bib,and Hpdc2-ligands in complex 1,while a 2D network is built by Ni(Ⅱ)and bib ligands in 2.Furthermore,the quantum⁃chemical calculations have been performed on‘molecular fragments’extracted from the crystal structure of 1 using the PBE0/LANL2DZ method in Gaussian 16 and the VASP program.CCDC:2343794,1;2343798,2.
基金Project(UKM-GUP-BTT-07-25-170) supported by Universiti Kebangsaan Malaysia
文摘The inhibition ability of 4-amino-5-phenyl-4H-1, 2, 4-trizole-3-thiol （APTT）, ethylenediaminetetra-acetic acid （EDTA） and thiourea （TU） for mild steel corrosion in 1.0 moFL HC1 solution at 30 ℃ was investigated. Tafel polarization and electrochemical impedance spectroscopy （EIS） were used to investigate the influence of these organic compounds as corrosion inhibitors of mild steel in 1.0 mol/L HC1 solution at 30 ℃. The inhibition mechanism was discussed in terms of Langrnuir isotherm model. Results obtained from Tafel polarization and impedance measurements are in a good agreement. The inhibition efficiency increases with the increase of the inhibitor concentration. The adsorption of the inhibitors on the mild steel surface follows Langmuir adsorption isotherm and the free energy of adsorption AGads indicates that the adsorption of APTT, EDTA, and TU molecules is a spontaneous process and a typical chemisorption.
基金Project(2007AA03Z0455) supported by the National High Technology Research and Development Program ("863" Program) of ChinaProject(BE2010194) supported by Science & Technology Pillar Program of Jiangsu in China+3 种基金Project(BE2009168) supported by Science & Technology Pillar Program of Jiangsu in ChinaProject supported by the Priority Academic Program Development (PAPD) of Jiangsu Higher Education InstitutionsProject(KF201103) supported by State Key Laboratory of New Ceramic and Fine Processing Tsinghua UniversityProject(CXZZ12_0415) supported by Innovation Foundation for Graduate Students of Jiangsu Province,China
文摘The effects of alkali oxides （Na2O and K2O addition on both the sintering behavior and dielectric properties of Ca-AI-B-Si-O glass/Al2O3 composites were investigated by Fourier transform infrared spectroscopy （FTIR）, differential scanning calorimeter （DSC）, X-ray diffractometry （XRD） and scanning electron microscopy （SEM）. The results show that the increasing amount of alkali oxides in the glass causes the decrease of [SiO4], which results in the decrease of the continuity of glass network, and leads to the decrease of the softening temperature Tf of the samples and the increasing trend of crystallization. And that deduces corresponding rise of densification, dielectric constant, dielectric loss of the low temperature co-fired ceramic （LTCC） materials and the decrease of its thermal conductivity. By contrast, the borosilicate glass/A1203 composites with 1.5% （mass fraction） alkali oxides sintered at 875 ℃ for 30 rain exhibit better properties of a bulk density of 2.79 g/cm3, a porosity of 0.48%, a 2 value of 2.28 W/（m.K）, a er value of 7.82 and a tand value of 9.1 × 10-4 （measured at 10 MHz）.
基金Project(2007BAE12800) supported by the National Supported Plan for Science and TechnologyProject(06FJ4059) supported by the Hunan Provincial Academician Foundation
文摘Using the mesophase pitch as precursor, KOH and CO2 as activated agents, the activated carbon electrode material was fabricated by physical-chemical combined activated technique for supercapacitor. The influence of activated process on the pore structure of activated carbon was analyzed and 14 F supercapacitor with working voltage of 2.5 V was prepared. The charge and discharge behaviors, the properties of cyclic voltammetry, specific capacitance, equivalent serials resistance （ESR）, cycle properties, and temperature properties of prepared supercapacitor were examined. The cyclic voltammetry curve results indicate that the carbon based supercapacitor using the self-made activated carbon as electrode materials shows the desired capacitance properties. In 1 mol/L Et4NBF4/AN electrolyte, the capacitance and ESR of the supercapacitor are 14.7 F and 60 mΩ respectively, The specific capacitance of activated carbon electrode materials is 99.6 F/g; its energy density can reach 2,96 W.h/kg under the large current discharge condition, There is no obvious capacitance decay that can be observed after 5000 cycles, The leakage current is below 0,2 mA after keeping the voltage at 2.5 V for l h, Meanwhile, the supercapacitor shows desired temperature property; it can be operated normally in the temperature ranging from -40 ℃to 70 ℃,
基金Project(50478003)supported by the National Natural Science Foundation of ChinaProject(2002F007)supported by the Natural Science Foundation of Fujian Province,China
文摘The effects of quality and content of fly ash on the early-age cracking behavior of high-flowing concrete （HFC） were investigated. The early-age cracking behavior of the HFC was analyzed by combining the tests of evaporation capacity and electrical resistivity of the HFC. In these tests, a modified flat-type specimen was adopted. The results show that the HFC will have a lower evaporation capacity when it is mixed with fine fly ash, while it will have a higher evaporation capacity when grade II! fly ash is used as mineral admixture. And the electrical resistivity rate of HFC reduces with the increase of the content of fly ash. A nonlinear relationship exists between the cracking time of HFC and the minimum electrical resistivity. The early-age cracking behavior of HFC with fly ash can be enhanced by appropriately increasing the fine particle content and MgO, K2O, and SO3 contents of fly ash. The optimal content of fly ash, which makes a satisfied early-age cracking behavior of HFC, is obtained. And when the content of fly ash exceeds a critical value, the early-age cracking behavior of HFC will rapidly decrease.
基金Project(50925417) supported by the National Funds for Distinguished Young Scientists,ChinaProject(50830301) supported by the Key program of the National Natural Science Foundation of ChinaProject(2012BAC12B03) supported by the National 12th Five-year Plan for Science and Technology Support,China
文摘A newly isolated bacterium was screened out for its survival on medium with 6 000 mg/L kraft lignin as the sole carbon source and energy, and identified as Pandoraea sp. by 16S rRNA gene sequence analysis. The biodegradation experiment was carried out in mineral salt medium, containing 5 000 mg/L kraft lignin as only carbon and energy at pH 8.0 and 30℃. Under these conditions, significant reduction in color and lignin content by the strain was observed after incubation for 5 d. The strain attains maximum reduction capability in color （44.6%） and lignin content （39.9%） within 5 d of incubation, and reduced chemical oxygen demand（COD） from initial concentration 7 399 to 3 980 mg/L at maximum reduction level of 46.2% on the 4th day. The total ion chromatograph （TIC） of compounds presented in the chloroform extract of control and bacterial treated samples shows the formation of several lignin-related aromatic compounds including some small molecular lignin fragments, indicating a strong destruction in the lignin structure.
基金Project (51134003) supported by the National Natural Science Foundation of China
文摘The oxidation behaviors of Ni-16Cr-xAl （x=4.5%, 9.0%, mass fraction） superalloy foams in air at 1000℃ were investigated. The effects of AI content on the resistance to high temperature oxidation were examined. The oxidation mechanisms of the foams were discussed. The results show that the resistance to the oxidation of the Ni-16Cr-xA1 based alloy at 1 000 ℃ increases with the content of A1 increasing from 4.5% to 9.0%. Complex oxide products are formed on the surface of the superalloy foams after the oxidation. Cr203 and A1203 are the predominant oxides for the scales of the foams with 4.5% A1 and 9% A1, respectively. Excellent high temperature oxidation resistance and superior pore conformation stability for the Ni-16Cr-xA1 based superalloy foam with 9% A1 can be mainly attributed to the formation of relatively continuous and protective A1203 oxides on the surface of the foam.
基金Project(2007CB613606) supported by the Major State Basic Research and Development Program of ChinaProject(50734007) supported by the National Natural Science Foundation of China
文摘Microwave absorbing properties of high titanium slag were investigated by using microwave cavity perturbation technique. High titanium slag containing more than 90% TiO2 was prepared by carbothermal reduction of ilmenite. The temperature rise curve of high titanium slag in microwave heating process was obtained. Crystalline compounds of high titanium slag before and after microwave irradiation were obtained and characterized by X-ray diffractometry （XRD）. Effects of particle size of high titanium slag anal mixtures of high titanium slag with different mass fractions of V2o5 on microwave absorbing properties were investigated systematically. The results show that high titanium slag has good microwave absorption property; untreated high titanium slag mainly consists of crystalline compounds of anatase and iron titanium oxide, while the microwave-irradiation treated one is mainly composed of crystalline compounds of rutile and irgn titanium oxide. Synthetic anatase is transformed completely into rutile at about 1 050 ℃ for 20 min under microwave irradiation. High frequency shift and low amplitude of voltage make high titanium slag an ideal microwave absorbent. 180 μm of particle size and 10% mass fraction of V2O5 are found to be the optimum conditions for microwave absorption.
基金Projects(2006BAJ02A08, 2006BAJ02A05) supported by the National Science and Technology Pillar Program Project during the 11th Five-Year Plan PeriodProject(2007-209) supported by the Excellent Youth Teacher of Ministry of Education of China
文摘The main objectives were to (1) calculate the total volatile organic compounds (TVOCs) inhalation dose, (2) analyze the proportions of human’s inhaled contaminant dose from different sources, and (3) present a newly defined ratio of relative inhalation dose level (RIDL) to assess indoor air quality (IAQ). A user defined function based on CFD (computational fluid dynamics) was developed, which integrated human motion model with TVOCs emission model in a high sidewall air supply ventilation mode. Based on simulation results of 10 cases, it is shown that the spatial concentration distribution of TVOCs is affected by human motion. TVOCs diffusion characteristic of building material is the most effective way to impact the TVOCs inhalation dose. From the RIDL index, case A-2 has the most serious IAQ problem, while case D-1 is of the best IAQ.
