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PE100管材料的聚集态结构和性能的固体NMR分析 被引量:11
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作者 严小伟 历伟 +4 位作者 任晓红 王靖岱 阳永荣 Siegfried Stapf Bernhard Blumich 《材料研究学报》 EI CAS CSCD 北大核心 2008年第2期157-163,共7页
PE100管材料基体树脂中界面区的含量比较高(高于10%),而完全无定形区的含量极低.界面区含量表征非晶区中运动部分受阻的链段所占的比重,因而上述结果意味着PE100管材料中非晶区中链段表现出强烈的缠结倾向.界面区的含量(或非晶区的组成... PE100管材料基体树脂中界面区的含量比较高(高于10%),而完全无定形区的含量极低.界面区含量表征非晶区中运动部分受阻的链段所占的比重,因而上述结果意味着PE100管材料中非晶区中链段表现出强烈的缠结倾向.界面区的含量(或非晶区的组成特征)决定了材料的耐慢速裂纹增长性能,而固相区含量则决定了材料的力学强度,两种影响因素的平衡决定了最终管材料的长期使用性能. 展开更多
关键词 有机高分子材料 PE100管材料 固体核磁共振 聚集态结构 力学性能
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合成吲哚生物碱的^1H NMR及立体化学 被引量:3
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作者 赵明 彭师奇 +1 位作者 毛希安 Ekkehard Winterfeldt 《波谱学杂志》 CAS CSCD 1995年第1期71-78,共8页
报道了5个咔啉和2个吲哚嗪的1HNMK数据.根据它们的COSY谱指定了各质子信号的归属.根据NOESY谱讨论了一些化合物的立体化学.Ⅰb的1—H与3—H存在NOE相关峰,说明1—H与3—CO2Me互为反式.Ⅲ的5'—... 报道了5个咔啉和2个吲哚嗪的1HNMK数据.根据它们的COSY谱指定了各质子信号的归属.根据NOESY谱讨论了一些化合物的立体化学.Ⅰb的1—H与3—H存在NOE相关峰,说明1—H与3—CO2Me互为反式.Ⅲ的5'—H与4'-H无NOE相关峰.偶合常数为9.0Hz,它们应为反式.V的1—CHO与2—H有NOE相关峰,说明1—H与2—OH为顺式.由于Ⅱa与Ⅱb有几乎完全相同的NOESY谱.它们的1—H取向只好由经验规律暂定. 展开更多
关键词 NMR 立体化学 吲哚生物碱
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Ni_3Ga中间相结构缺陷的热力学和统计热力学分析
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作者 袁文霞 乔芝郁 +1 位作者 O.Ssemenova H.Ipser 《北京科技大学学报》 EI CAS CSCD 北大核心 2000年第3期202-204,共3页
使用以稳定的ZrO2为电解质的高温固体电解质电池电动势方法测量了Ni3Ga非整比金属间化合物1073至1273K均相范围内Ga的活度,计算了偏摩尔焓和偏摩尔摘等热力学性质.考虑4种点缺陷,即分别在2个亚晶格上的反结构原子和空位共存于该Ll2... 使用以稳定的ZrO2为电解质的高温固体电解质电池电动势方法测量了Ni3Ga非整比金属间化合物1073至1273K均相范围内Ga的活度,计算了偏摩尔焓和偏摩尔摘等热力学性质.考虑4种点缺陷,即分别在2个亚晶格上的反结构原子和空位共存于该Ll2型化合物中,各缺陷生成自由能为可调参数:Ef(Aβ)=0.60eV,Ef(Bα)=0.60eV,EfV(α)=1.5eV,EfV(β)=2.0eV,用统计热力学方法推导了Ni3Ga非整比化合物均相范围内缺陷浓度及其与温度和成分的关系,得到1123K时整比处的无序参数a’=0.0009. 展开更多
关键词 金属间化合物 结构缺陷 统计热力学 Ni3Ga
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吲哚喹嗪衍生物的立体选择性合成及环合机理
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作者 彭师奇 董颖 Ekkehard Winterfeldt 《自然科学进展(国家重点实验室通讯)》 1993年第3期245-251,共7页
在相转移条件下,咔啉衍生物实施的环合反应,是对映纯吲哚喹嗪衍生物全合成中的重要进展之一;相同条件下,咔啉衍生物6S,R和6S,S环合,生成期待的吲哚喹嗪衍生物(7S,R,7S,S,8S,R,8S,S),表明这种类型的环合具有良好的适应性.在咔啉的3位引... 在相转移条件下,咔啉衍生物实施的环合反应,是对映纯吲哚喹嗪衍生物全合成中的重要进展之一;相同条件下,咔啉衍生物6S,R和6S,S环合,生成期待的吲哚喹嗪衍生物(7S,R,7S,S,8S,R,8S,S),表明这种类型的环合具有良好的适应性.在咔啉的3位引入羟甲基,不仅为吲哚喹嗪环提供了新功能基,还为进一步进行结构修饰奠定了基础;该功能基的引入使本文能成功地分离醛酮中间体9S,R和9S,S,为阐明上述环合反应机理提供了实验证据. 展开更多
关键词 吲哚喹嗪 衍生物 环合机理
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Endophytes as Producers of Peptides:An Overview About the Recently Discovered Peptides from Endophytic Microbes 被引量:5
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作者 Muna Ali Abdalla Josphat C.Matasyoh 《Natural Products and Bioprospecting》 CAS 2014年第5期257-270,共14页
An endophyte is a fungus or bacterium that lives within a plant in a symbiotic relationship.Extensive colonization of the plant tissue by endophytes creates a barrier effect,where they outcompete and prevent pathogen... An endophyte is a fungus or bacterium that lives within a plant in a symbiotic relationship.Extensive colonization of the plant tissue by endophytes creates a barrier effect,where they outcompete and prevent pathogenic organisms from taking hold.This happens by producing secondary metabolites that inhibit the growth of the competitors or pathogens.In this way they play a very important role in the plant defence mechanisms.The metabolites produced by these endophytes fall within a wide range of classes of compounds that include peptides which are the focus of this review.Peptides are increasingly being selected for drug development because they are specific for their targets and have a higher degree of interactions.There have been quite a number of endophytic peptides reported in the recent past indicating that endophytes can be used for the production of peptide based drugs.Molecular screening for NRPS,which shows peptide producing capability,has also shown that endophytes are potential producers of peptides.The presence of NRPS also offers the possibility of genetic modifications which may generate peptides with high pharmacological activities.This review,therefore,aims to show the current status of peptides isolated from endophytic bacteria and fungi in the recent decade.Endophytes as potential sources of peptides according to NRPS studies will also be discussed. 展开更多
关键词 PEPTIDES ENDOPHYTES NRPS BIOACTIVITIES Genetic engineering
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苔藓Bazzania japonica挥发油的化学成分研究
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作者 朱天涛 宋春风 +1 位作者 鲁润华 Wilfried A. Konig 《天然产物研究与开发》 CAS CSCD 2007年第B05期54-56,共3页
采用水蒸气蒸馏法提取苔藓Bazzania japonica的挥发油,用毛细管色谱法对挥发油进行了分析,采用归一化法确定各组分的相对含量,并用GC-MS联用技术对分离的化学成分进行鉴定。经计算机检索并结合文献调研,共鉴定出38个化合物,占挥发... 采用水蒸气蒸馏法提取苔藓Bazzania japonica的挥发油,用毛细管色谱法对挥发油进行了分析,采用归一化法确定各组分的相对含量,并用GC-MS联用技术对分离的化学成分进行鉴定。经计算机检索并结合文献调研,共鉴定出38个化合物,占挥发油总量的83%,其中含2个单萜、31个倍半萜(其中11个为含氧倍半萜)和4个二萜(其中1个为含氧二萜),主要成分为4-epi-11-nor—aristola-1(10),11-diene(10.5%),4-epi-11-nor-aristo-la-1,9,11-triene(6.5%),β-caryophyllene(8.0%),β—barbatene(7.2%),globulol(8.8%),aristol-1(10)-en-12-ol(9.1%),和tridensenone(8.7%). 展开更多
关键词 苔藓 Bazzania JAPONICA 挥发油 倍半萜 GC GC-MS
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Multiply Charged Anions,Maximum Charge Acceptance,and Higher Electron Affinities of Molecules,Superatoms,and Clusters
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作者 VON SZENTPáLY László 《物理化学学报》 SCIE CAS CSCD 北大核心 2018年第6期675-682,共8页
The addition of electrons to form gas-phase multiply charged anions(MCAs)normally requires sophisticated experiments or calculations.In this work,the factors stabilizing the MCAs,the maximum electron uptake of gas-pha... The addition of electrons to form gas-phase multiply charged anions(MCAs)normally requires sophisticated experiments or calculations.In this work,the factors stabilizing the MCAs,the maximum electron uptake of gas-phase molecules,X,and the electronic stability of MCAs X^(Q-),are discussed.The drawbacks encountered when applying computational and/or conceptual density functional theory(DFT)to MCAs are highlighted.We develop and test a different model based on the valence-state concept.As in DFT,the electronic energy,E(N,v_(ex)),is a continuous function of the average electron number,N,and the external potential,v_(ex),of the nuclei.The valence-state-parabola is a second-order polynomial that allows extending E(N,v_(ex))to dianions and higher MCAs.The model expresses the maximum electron acceptance,Q_(max),and the higher electron affinities,A_Q,as simple functions of the firstelectron affinity,A_1,and the ionization energy,I,of the"ancestor"system.Thus,the maximum electron acceptance is Q_(max,calc)=1+12A_1/7(I-A_1).The ground-state parabola model of the conceptual DFT yields approximately half of this value,and it is termed Q_(max,GS)=?+A_1/(I-A_1).A large variety of molecules are evaluated including fullerenes,metal clusters,super-pnictogens,super-halogens(OF_3),super-alkali species(OLi_3),and neutral or charged transition-metal complexes,AB_(m )L_n^(0/+/-).The calculated second electron affinity A_(2,calc)=A_1-(7/12)(I-A_1)is linearly correlated to the literature references A_(2,lit) with a correlation coefficient R=0.998.A_2 or A_3 values are predicted for further 24 species.The appearance sizes,n_(ap)^(3-),of triply charged anionic clusters and fullerenes are calculated in agreement with the literature. 展开更多
关键词 Multiply CHARGED negative ions Their appearance sizes Second electron AFFINITY Third electronaffinity Conceptual density-functional theory Valence-state PARABOLA model of ELECTRONEGATIVITY
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ENVIRONMENTAL BEHAVIOR OF LINEAR ALKYLBENZENE SULFONATE (LAS) IN AQUATIC ECOSYSTEM
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作者 张甬元 谭渝云 F.Korte 《Chinese Journal of Oceanology and Limnology》 SCIE CAS CSCD 1991年第1期78-87,共10页
LAS degradation rate in Donghu Lake water under aerobic was much faster than under anaerobic condition . The half life of LAS in aerobic and anaerobic environment was 3.2 days and 57 days, respectively . The degradati... LAS degradation rate in Donghu Lake water under aerobic was much faster than under anaerobic condition . The half life of LAS in aerobic and anaerobic environment was 3.2 days and 57 days, respectively . The degradation rate at 25-27℃was approximately 20 times higher than that at 1.5-3.5℃.In a laboratory model aquatic ecosystem, two stages of bioconcentration in fish , daphnia and snail were observed . The first stage , on second day exposure , resulted from accumulation of intact LAS , and the second stage , on 16th day exposure , was due to metabolites . The bioconcentration factor (BCF) of LAS was extremely low in the muscle of hybrid carp (0.64), but rather high (2485) in the gall bladder . 展开更多
关键词 ANAEROBIC AQUATIC exposure degraded biodegradation DIGESTION BLADDER INTACT extremely REMOVE
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Rotational Spectra and Molecular Structures of Ethylanilines
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作者 Juan Wang Sven Herbers +4 位作者 Philipp Buschmann Kevin Lengsfeld Jens-Uwe Grabow Gang Feng Qian Gou 《Chinese Journal of Chemical Physics》 SCIE CAS CSCD 2020年第1期119-124,I0034-I0076,共49页
The molecular structures of three ethylanilines,ortho-,meta-and para-ethylaniline,have been obtained by means of Fourier-transform microwave spectroscopy.Rotational spectra of all three molecules display the nuclear q... The molecular structures of three ethylanilines,ortho-,meta-and para-ethylaniline,have been obtained by means of Fourier-transform microwave spectroscopy.Rotational spectra of all three molecules display the nuclear quadrupole hyperfine structures arising from the 14N nucleus.Comparison of the determined structures allows a direct study of the influence of the position of the ethyl substituent on the structure of the amino group communicated through the phenyl ring. 展开更多
关键词 Rotational spectroscopy Molecular structure Supersonic expansion Quadrupole coupling effect
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Synthesis and Characterization of La_(0.8)Sr_(0.2)MnO_(3−δ) Nanostructures for Solid Oxide Fuel Cells
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作者 V.S.Reddy Channu Rudolf Holze Edwin H.Walker 《New Journal of Glass and Ceramics》 2013年第1期29-33,共5页
La0.8Sr0.2MnO3-δ (LSM) perovskite was synthesized using different methods, such as solid state reaction, soft-chemical and sol-gel methods for solid oxide fuel cells (SOFCs) for use as a cathode material. The pristin... La0.8Sr0.2MnO3-δ (LSM) perovskite was synthesized using different methods, such as solid state reaction, soft-chemical and sol-gel methods for solid oxide fuel cells (SOFCs) for use as a cathode material. The pristine material was characterized by X-ray diffraction, thermogravimetric analysis (TGA), differential scanning calorimetry (DSC) and scanning electron microscopy (SEM). X-ray diffraction results show that the pure phase of La0.8Sr0.2MnO3-δ (LSM) perovskite was formed at 1250oC. Scanning electron microscopy characterization shows that a highly porous material can be obtained using a soft-chemical method with different 3,3’,3”-nitrilotripropionic acid ( NTP) to metal-ion ratio R. 展开更多
关键词 Porous Materials Characterization Techniques CATHODE
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Optical Properties of Rhodamine 6G Doped AlPO4 Gel
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作者 李日红 唐彬 +2 位作者 范有余 任进军 张龙 《Chinese Physics Letters》 SCIE CAS CSCD 2010年第10期217-219,共3页
Homogeneous monolith of A1PO4 gel doped with rhodamine 6G (Rh6G) at different dye loadings is prepared by a one-step process with sol-gel method using the precursors A1(lact)3 and H3PO4. The optical properties of ... Homogeneous monolith of A1PO4 gel doped with rhodamine 6G (Rh6G) at different dye loadings is prepared by a one-step process with sol-gel method using the precursors A1(lact)3 and H3PO4. The optical properties of A1PO4 gel doped with Rh6G are characterized by UV-Visible absorption spectra and fluorescence spectra. Rh6G molecular J-dimers and H-dimers even multimers are analyzed by excitation spectra based on exciton theory. The A1PO4 gel doped with Rh6G dye with molar ratio of Rh6G/A1(lact)3 of 1 × 10-4 has excellent optical properties without obvious aggregates. 展开更多
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Effects of temperature and sodium carboxylate additives on mineralization of calcium oxalate in silica gel systems 被引量:8
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作者 Bernd Tieke 《Science China Chemistry》 SCIE EI CAS 2004年第4期311-319,共9页
The effects of temperature and multifunctional sodium carboxylate additives on the phase composition and morphology of calcium oxalate (CaOxa) crystals grown in silica gel sys-tem were systematically investigated usin... The effects of temperature and multifunctional sodium carboxylate additives on the phase composition and morphology of calcium oxalate (CaOxa) crystals grown in silica gel sys-tem were systematically investigated using scanning electron microscopy (SEM), powder X-ray diffraction (XRD), and Fourier-transform infrared spectra (FT-IR). The sodium carboxylates in-vestigated include: monocarboxylate sodium acetate (NaAc), disodium tartrate (Na2tart), triso-dium citrate (Na3cit), and the disodium salt of ethylenediaminetetraacetic acid (Na2edta). The temperature range was from 7℃ to 67℃. The crystallization temperature affects the phase compositions, the growth rate, and the morphology of CaOxa. First, the logarithm of the per-centage of calcium oxalate dihydrate (COD) formed at a certain temperature (T) is proportional to the reciprocal of temperature (1/T). Second, the weight of CaOxa crystals decreases as de-creasing the temperature. At a given temperature, the ability of the sodium carboxylates to in-duce COD follows the order: Na2edta > Na3cit > Na2tart >> NaAc. Third, the multicarboxylates can decrease the surface area of calcium oxalate monohydrate (COM). It makes the edges and tips of COM crystals blunt and oval. All the three changes, an increase of the content of COD, a decrease of the weight of CaOxa crystals, and a decrease of the surface area of COM crystals, can inhibit the formation of CaOxa stones. These results support the clinical use of citrates and may be helpful in elucidating the mechanisms of the formation of CaOxa calculus. 展开更多
关键词 钙盐 钠羧化物 胶化 尿演算 结晶化 BIOMINERALIZATION
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Mussel-inspired multifunctional coating for bacterial infection prevention and osteogenic induction 被引量:1
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作者 Mingjun Li Christoph Schlaich +7 位作者 Jianguang Zhang Ievgen S.Donskyi Karin Schwibbert Frank Schreiber Yi Xi Jorg Radnik Tanja Schwerdtle Rainer Haag 《Journal of Materials Science & Technology》 SCIE EI CAS CSCD 2021年第9期160-171,共12页
Bacterial infection and osteogenic integration are the two main problems that cause severe complications after surgeries. In this study, the antibacterial and osteogenic properties were simultaneously introduced in bi... Bacterial infection and osteogenic integration are the two main problems that cause severe complications after surgeries. In this study, the antibacterial and osteogenic properties were simultaneously introduced in biomaterials, where copper nanoparticles(Cu NPs) were generated by in situ reductions of Cu ions into a mussel-inspired hyperbranched polyglycerol(MI-h PG) coating via a simple dip-coating method.This hyperbranched polyglycerol with 10 % catechol groups’ modification presents excellent antifouling property, which could effectively reduce bacteria adhesion on the surface. In this work, polycaprolactone(PCL) electrospun fiber membrane was selected as the substrate, which is commonly used in biomedical implants in bone regeneration and cardiovascular stents because of its good biocompatibility and easy post-modification. The as-fabricated Cu NPs-incorporated PCL membrane [PCL-(MI-h PG)-Cu NPs]was confirmed with effective antibacterial performance via in vitro antibacterial tests against Staphylococcus aureus(S. aureus), Escherichia coli(E. coli), and multi-resistant E. coli. In addition, the in vitro results demonstrated that osteogenic property of PCL-(MI-h PG)-Cu NPs was realized by upregulating the osteoblast-related gene expressions and protein activity. This study shows that antibacterial and osteogenic properties can be balanced in a surface coating by introducing Cu NPs. 展开更多
关键词 Mussel-inspired coating CuNPs Multi-resistant bacteria ANTIBACTERIAL ANTIFOULING OSTEOGENESIS
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Protective effect of glycine on liver injury during liver transplantation 被引量:1
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作者 WANG Yao-sheng YAN Ye-hong ZOU Xun-feng 《Chinese Medical Journal》 SCIE CAS CSCD 2010年第14期1931-1938,共8页
Multiple procedures of liver transplantation bring conditions producing cold ischemia-reperfusion (I/R) injury. During cold storage, the graft organ is subjected to cold ischemia, also known as hypoxia injury. Afte... Multiple procedures of liver transplantation bring conditions producing cold ischemia-reperfusion (I/R) injury. During cold storage, the graft organ is subjected to cold ischemia, also known as hypoxia injury. After reperfusion, although hypoxic condition has been ameliorated, reoxygenation of the graft liver can produce not only reperfusion injury including generation of oxygen free radical, lipoperoxidation and calcium overload, but also aggravate the hypoxia damage, 展开更多
关键词 GLYCINE reperfusion injury liver transplantation Kupffer cells
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Chapter model systems in heterogeneous catalysis at the atomic level: a personal view
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作者 Hans-Joachim Freund Markus Heyde +5 位作者 Helmut Kuhlenbeck Niklas Nilius Thomas Risse Thomas Schmidt Shamil Shaikhutdinov Martin Sterrer 《Science China Chemistry》 SCIE EI CAS CSCD 2020年第4期426-447,共22页
The review presents an overview of studies in the surface science of oxide and related surfaces with an emphasis of the studies performed in the authors’ group. Novel instruments and technique developments, as well a... The review presents an overview of studies in the surface science of oxide and related surfaces with an emphasis of the studies performed in the authors’ group. Novel instruments and technique developments, as well as their applications are reported, in an attempt to cover studies on model systems of increasing complexity, including some of the key ingredients of an industrially applied heterogeneous catalyst and its fabrication. The review is intended to demonstrate the power of model studies in understanding heterogeneous catalysis at the atomic level. The studies include those on supported nano-particles, both, prepared in vacuum and from solution, interaction of surfaces and the underlying bulk with molecules from the gas phase, strong metal support interaction, as well as the first attempt to include studies on reactions in confined spaces. 展开更多
关键词 model catalysts oxide surfaces structure and spectroscopy SUPPORTED nanoparticles REACTIONS in the CONFINED space
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Impact of Molecular Shape on Supramolecular Copolymer Synthesis in Seeded Living Polymerization of Perylene Bisimides
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作者 Wolfgang Wagner Marius Wehner +1 位作者 Vladimir Stepanenko Frank Wurthner 《CCS Chemistry》 CAS 2019年第5期598-613,共16页
Supramolecular polymerization properties have been studied for a series of perylene bisimide(PBI)dyes containing identical hydrogen-bonding amide groups in imide positions but variable number or size of alkoxy substit... Supramolecular polymerization properties have been studied for a series of perylene bisimide(PBI)dyes containing identical hydrogen-bonding amide groups in imide positions but variable number or size of alkoxy substituents in bay-positions. 展开更多
关键词 supramolecular polymer SELF-ASSEMBLY living supramolecular polymerization block copoly-mers perylene bisimides
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Fast Evaporation Enabled Ultrathin Polymer Coatings on Nanoporous Substrates for Highly Permeable Membranes
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作者 Xiansong Shi Lei Wang +4 位作者 Nina Yan Zhaogen Wang Leiming Guo Martin Steinhart Yong Wang 《The Innovation》 2021年第1期93-99,共7页
Thin polymer coatings covering on porous substrates are a common composite structure required in numerous applications,including membrane separation,and there is a strong need to push the coating thicknesses down to t... Thin polymer coatings covering on porous substrates are a common composite structure required in numerous applications,including membrane separation,and there is a strong need to push the coating thicknesses down to the nanometer scale to maximize the performances.However,producing such ultrathin polymer coatings in a facile and efficient way remains a big challenge.Here,uniform ultrathin polymer covering films(UPCFs)are realized by a facile and general approach based on rapid solvent evaporation.By fast evaporating dilute polymer solutions spread on the surface of porous substrates,we obtain ultrathin coatings(down to30 nm)exclusively on the top surface of porous substrates,forming UPCFs with a block copolymer of polystyrene-blockpoly(2-vinyl pyridine)at room temperature or a homopolymer of poly(vinyl alcohol)(PVA)at elevated temperatures.Upon selective swelling of the block copolymer and crosslinking of PVA,we obtain highly permeable membranes delivering2–10 times higher permeance in ultrafiltration and pervaporation than state-of-the-art membranes with comparable selectivities.We have invented a very convenient but highly efficient process for the direct preparation of defective-free ultrathin coatings on porous substrates,which is extremely desired in different fields in addition to membrane separation. 展开更多
关键词 fast evaporation ultrathin film block copolymer selective swelling membrane separation
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Preparation of Composited Graphene/PEDOT:PSS Film for Its Possible Application in Graphene-based Organic Solar Cells
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作者 YU Yue LI Meicheng +4 位作者 CHU Lihua YU Hakki Wodtke A.M. ZHAO Yan ZHANG Zhongmo 《Journal of the Chinese Ceramic Society》 2015年第2期65-68,共4页
The interface between graphene and organic layers is a key factor responsible for the performance of graphene-based organic solar cells(OSCs). In this paper, we focus on coating PEDOT:PSS onto the surface of graphene.... The interface between graphene and organic layers is a key factor responsible for the performance of graphene-based organic solar cells(OSCs). In this paper, we focus on coating PEDOT:PSS onto the surface of graphene. We demonstrate two approaches, applying UV/Ozone treatment on graphene and modifying PEDOT:PSS with Zonyl, to get a PEDOT:PSS well-coated graphene film. Our results prove that both methods can be effective to solve the interface issue between graphene and PEDOT: PSS. Thereby it shows a positive application of the composited graphene/PEDOT:PSS film on graphene-based OSCs. 展开更多
关键词 GRAPHENE PEDOT:PSS COMPOSITE materials COATING
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