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Unravelling the bottleneck of phosphonic acid anchoring groups aiming toward enhancing the stability

《化学科学与工程前沿（英文）》 2022年 第16卷 第7期   页码 1060-1078 doi: 10.1007/s11705-021-2117-z

摘要： Novel near-infrared sensitizers with different anchoring groups aiming toward improved stability and efficiency of dye-sensitized solar cells were synthesized. Adsorption of these dyes on the mesoporous TiO2 surface revealed the dye adsorption rate of –CH=CH–COOH (SQ-139)>–CH=C(CN)COOH (SQ-140)>–PO3H2 (SQ-143)>–CH=C(CN)PO3H2 (SQ-148)>–CH=C(CN)PO3H–C2H5 (SQ-157)>–PO3H–C2H5 (SQ-151)>–CH=CH–COOH(–PO3H2) (SQ-162). The binding strength of these dyes on mesoporous TiO2 as investigated by dye desorption studies follows SQ-162>SQ-143>SQ-148>SQ-139>SQ-157~SQ-151>SQ-140 order. The acrylic acid anchoring group was demonstrated to be an optimum functional group owing to its fast dye adsorption rate and better binding strength on TiO2 along with good photoconversion efficiency. Results of dye binding on TiO2 surface demonstrated that SQ-162 bearing double anchoring groups of phosphonic and acrylic acid exhibited>550 times stronger binding as compared to dye SQ-140 having cyanoacrylic acid anchoring group. SQ-140 exhibited the best photovoltaic performance with photon harvesting mainly in the far-red to near-infrared wavelength region having short circuit current density, open-circuit voltage and fill factor of 14.28 mA·cm–2, 0.64 V and 0.65, respectively, giving the power conversion efficiency of 5.95%. Thus, dye SQ-162 not only solved the problem of very poor efficiency of dye bearing only phosphonic acid while maintaining the extremely high binding strength opening the path for the design and development of novel near-infrared dyes with improved efficiency and stability by further increasing the π-conjugation.

关键词： anchoring groups     adsorption behaviour     dye-binding strength     squaraine dyes     dye-sensitized solar cells    

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Effects of functional groups for CO

Chenkai Gu, Yang Liu, Weizhou Wang, Jing Liu, Jianbo Hu

《化学科学与工程前沿（英文）》 2021年 第15卷 第2期   页码 437-449 doi: 10.1007/s11705-020-1961-6

摘要： Metal organic frameworks (MOFs) are promising adsorbents for CO capture. Functional groups on organic linkers of MOFs play important roles in improving the CO capture ability by enhancing the CO sorption affinity. In this work, the functionalization effects on CO adsorption were systematically investigated by rationally incorporating various functional groups including –SO H, –COOH, –NH , –OH, –CN, –CH and –F into a MOF-177 template using computational methods. Asymmetries of electron density on the functionalized linkers were intensified, introducing significant enhancements of the CO adsorption ability of the modified MOF-177. In addition, three kinds of molecular interactions between CO and functional groups were analyzed and summarized in this work. Especially, our results reveal that –SO H is the best-performing functional group for CO capture in MOFs, better than the widely used –NH or –F groups. The current study provides a novel route for future MOF modification toward CO capture.

关键词： metal-organic frameworks     functional groups     CO2 capture     GCMC     DFT    

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Experimental study on the progressive failure and its anchoring effect of weak-broken rock vertical slope

Hehua ZHU, Qianwei XU, Wenqi DING, Feng HUANG

《结构与土木工程前沿（英文）》 2011年 第5卷 第2期   页码 208-224 doi: 10.1007/s11709-011-0111-0

摘要： To improve the understanding on the failure behavior and its anchoring effect of weak-broken rock slope, the rock of grade IV according to China is taken as reference prototype, and a series of model tests were carried out in laboratory. These tests can be divided into two categories, that is, with bolt reinforcement and without bolt reinforcement. In which, the stability of slope reinforced with different bolt diameter, different anchor length and different space are studied. The test results show that the collapse of slope is the combination of tension failure at the top and the compression-shearing failure at the bottom of the slope, and its failure process presents progressive characteristics. The contributions of bolt reinforcement are mainly reflected by the aspects of shear resistance, crack resistance and anti-extension. The reinforcement of blot not only can improve the vertical bearing capacity before failure, but also can reduce the vertical settlement and allow greater lateral rock wall deformation; what is more, the stress concentration degree in rock mass can be dispersed, which do help to improve the stability of slope rock mass.

关键词： progressive failure     weak-broken rock     slope     model test     bolt    

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Characterization and comparison of organic functional groups effects on electrolyte performance for vanadium

《化学科学与工程前沿（英文）》 2023年 第17卷 第9期   页码 1221-1230 doi: 10.1007/s11705-023-2298-8

摘要： The vanadium redox flow battery with a safe and capacity-controllable large-scale energy storage system offers a new method for the sustainability. In this case, acetic acid, methane sulfonic acid, sulfonic acid, amino methane sulfonic acid, and taurine are used to overcome the low electrolyte energy density and stability limitations, as well as to investigate the effects of various organic functional groups on the vanadium redox flow battery. When compared to the pristine electrolyte (0.22 Ah, 5.0 Wh·L–1, 85.0%), the results show that taurine has the advantage of maintaining vanadium ion concentrations, discharge capacity (1.43 Ah), energy density (33.9 Wh·L–1), and energy efficiency (90.5%) even after several cycles. The acetic acid electrolyte is more conducive to the low-temperature stability of the V(II) electrolyte (177 h at −25 °C) than pristine (82 h at −2 °C). The –SO3H group, specifically the coaction of the –NH2 and –SO3H groups, improves electrolyte stability. The –NH2 and –COOH additive groups improved conductivity and electrochemical activity.

关键词： vanadium redox flow battery     functional groups     organic additives     energy density     stability    

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Influence of axial load on the lateral pile groups response in cohesionless and cohesive soil

Jasim M. ABBASA,Zamri CHIK,Mohd Raihan TAHA

《结构与土木工程前沿（英文）》 2015年 第9卷 第2期   页码 176-193 doi: 10.1007/s11709-015-0289-7

摘要： The lateral response of single and group of piles under simultaneous vertical and lateral loads has been analyzed using a 3D finite element approach. The response in this assessment considered lateral pile displacement and lateral soil resistance and corresponding - curve. As a result, modified - curves for lateral single pile response were improved with respect to the influence of increasing axial load intensities. The improved plots can be used for lateral loaded pile design and to produce the group action design -multiplier curves and equations. The effect of load combination on the lateral pile group response was performed on three pile group configurations (i.e., 2×1, 2×2 and 3×2) with four pile spacings (i.e., = 2 , 4 , 6 and 8 ). As a result, design curves were developed and applied on the actual case studies and similar expected cases for assessment of pile group behavior using improved p-multiplier. A design equation was derived from predicted design curves to be used in the evaluation of the lateral pile group action taking into account the effect of axial load intensities. It was found that the group interaction effect led to reduced lateral resistance for the pile in the group relative to that for the single pile in case of pure lateral load. While, in case of simultaneous combined loads, large axial load intensities (i.e., more than 6 , where is lateral load values) will have an increase in -multiplier by approximately 100% and will consequently contribute to greater group piles capacities.

关键词： piles     pile group     spacing     configuration     combined load    

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Insight into the effect of surface carboxyl and amino groups on the adsorption of titanium dioxide for

Wenlong Zhang, Xuyang Zhao, Lin Zhang, Jinwei Zhu, Shanshan Li, Ping Hu, Jiangtao Feng, Wei Yan

《化学科学与工程前沿（英文）》 2021年 第15卷 第5期   页码 1147-1157 doi: 10.1007/s11705-020-1978-x

摘要： In this study, TiO functionalized with organic groups were prepared to study the effect of carboxyl and amino groups on the adsorption behavior of TiO for the removal of acid red G (ARG) as an anionic dye from aqueous solution. TiO was successfully modified with carboxyl and amino groups by using the hydrolysis method with oxalic acid (OAD, with two carboxyl groups), ethylenediamine (EDA, with two amino groups) and DL-alanine (DLA, with one carboxyl group and one amino group) at low temperature (65 °C) and labeled as OAD-TiO , EDA-TiO and DLA-TiO , respectively. The ARG uptake by the functionalized TiO samples was largely dependent on the functional groups. The interaction between ARG and the functional organic groups on the TiO samples plays an important role in the adsorption process, which leads to the excellent adsorption performance (higher capacity and faster adsorption rate) of the functionalized TiO samples than that of P25 (commercial TiO without modification). Furthermore, there is no obvious loss of the adsorption capacity for the functionalized TiO even after 5 adsorption-desorption cycles, which indicated the good reusability of the modified TiO samples for anionic dye removal from aqueous solution.

关键词： amino group     carboxylic group     titanium dioxide     ARG     adsorption    

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Finite element prediction on the response of non-uniformly arranged pile groups considering progressive

Qian-Qing ZHANG, Shan-Wei LIU, Ruo-Feng FENG, Jian-Gu QIAN, Chun-Yu CUI

《结构与土木工程前沿（英文）》 2020年 第14卷 第4期   页码 961-982 doi: 10.1007/s11709-020-0632-5

摘要： A uniform arrangement of individual piles is commonly adopted in the conventional pile group foundation, and basin-shaped settlement is often observed in practice. Large differential settlement of pile groups will decrease the use-safety requirements of building, even cause the whole-building tilt or collapse. To reduce differential settlement among individual piles, non-uniformly arranged pile groups can be adopted. This paper presents a finite element analysis on the response of pile groups with different layouts of individual piles in pile groups. Using the user-defined subroutine FRIC as the secondary development platform, a softening model of skin friction and a hyperbolic model of end resistance are introduced into the contact pair calculation of ABAQUS software. As to the response analysis of a single pile, the reliability of the proposed secondary development method of ABAQUS software is verified using an iterative computer program. The reinforcing effects of individual piles is then analyzed using the present finite element analysis. Furthermore, the response of non-uniformly arranged pile groups, e.g., individual piles with variable length and individual piles with variable diameter, is analyzed using the proposed numerical analysis method. Some suggestions on the layout of individual piles are proposed to reduce differential settlement and make full use of the bearing capacity of individual piles in pile groups for practical purposes.

关键词： numerical simulation     non-uniformly arranged pile groups     differential settlement     pile-soil interaction    

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Novel precision piezoelectric step rotary actuator

LIU Jianfang, YANG Zhigang, ZHAO Hongwei, CHENG Guangming

《机械工程前沿（英文）》 2007年 第2卷 第3期   页码 356-360 doi: 10.1007/s11465-007-0062-2

摘要： A novel piezoelectric (PZT) precision step rotary actuator was developed on the basis of PZT technology. It adopts the principle of bionics and works with an inside anchoring/loosening of the stator and a distortion structure of the uniformly distributed thin flexible hinge to solve problems such as ineffective anchoring/loosening, low step rotary frequency, small travel, poor resolution, low speed and unsteady output. The developed actuator is characterized by high frequency (30 Hz), high speed (380 μrad/s), large travel (>270º), high resolution (1 μrad/step), and work stability. It greatly improves the ability to drive the existing PZT step rotary actuator. The new actuator can be applied in the field of micromanipulation and precision engineering, including precision driving and positioning and optics engineering.

关键词： developed     stability     ineffective anchoring/loosening     technology     piezoelectric    

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Modeling oblique load carrying capacity of batter pile groups using neural network, random forest regression

Tanvi SINGH, Mahesh PAL, V. K. ARORA

《结构与土木工程前沿（英文）》 2019年 第13卷 第3期   页码 674-685 doi: 10.1007/s11709-018-0505-3

摘要： M5 model tree, random forest regression (RF) and neural network (NN) based modelling approaches were used to predict oblique load carrying capacity of batter pile groups using 247 laboratory experiments with smooth and rough pile groups. Pile length ( ), angle of oblique load ( ), sand density ( ), number of batter piles ( ), and number of vertical piles ( ) as input and oblique load ( ) as output was used. Results suggest improved performance by RF regression for both pile groups. M5 model tree provides simple linear relation which can be used for the prediction of oblique load for field data also. Model developed using RF regression approach with smooth pile group data was found to be in good agreement for rough piles data. NN based approach was found performing equally well with both smooth and rough piles. Sensitivity analysis using all three modelling approaches suggest angle of oblique load ( ) and number of batter pile ( ) affect the oblique load capacity for both smooth and rough pile groups.

关键词： batter piles     oblique load test     neural network     M5 model tree     random forest regression     ANOVA    

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中国岩石工程技术的新进展

钱七虎

《中国工程科学》 2010年 第12卷 第8期   页码 37-48

摘要：

在水电建设的岩石工程技术方面，介绍了三峡船闸高边坡稳定性及监控施工技术；深切河谷水电工程高边坡稳定性和支护技术；大跨度高边墙地下洞室群围岩稳定技术。在公路、铁路建设中的岩石工程技术方面，介绍了青藏铁路——穿越长年冻土层的施工技术；公路、铁路隧道中乌鞘岭隧道挤压大变形支护技术，高寒高海拔的风火山隧道、二郎山隧道施工技术；岩溶地区隧道超前地质预报技术。在矿业工程的岩石工程技术方面，介绍了煤矿巷道支护成套技术创新体系；低透气性煤层群无煤柱煤与瓦斯共采技术；深凹露天矿安全高效开采技术。另外，还介绍了岩石工程锚固新技术和精细爆破技术。

关键词： 岩石工程     水电工程     支护技术     地质预报     锚固技术     爆破技术    

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Using sound Clinical Paths and Diagnosis-related Groups (DRGs)-based payment reform to bring benefits

Zhi-Ruo ZHANG PhD, Jian-Qing MI MD, Zhao-Jun WEN MA, Sai-Juan CHEN MD, PhD, Zhu CHEN PhD, Long-Jun GU MD, Jing-Yan TANG MD, PhD, Shu-Hong SHEN MD, PhD,

《医学前沿（英文）》 2010年 第4卷 第1期   页码 8-15 doi: 10.1007/s11684-010-0018-5

摘要： China has been undertaking a profound reform on health care. Although more than 1.16 billion people have been covered by rural and urban medical insurance to date, the level of reimbursement from insurance is very limited, especially for critical diseases such as leukemia. This places heavy economic burdens on patients. Under these circumstances, systems innovation is imperative for the efficient utilization of limited funding. In this respect, certain valuable experience from other countries may prove helpful. The prospective payment system of Diagnosis-related Groups (DRGs), Clinical Paths, and the Comparative Effectiveness Analysis adopted by the National Institute of Health and Clinical Excellence (NICE, UK), can be fine tools to reduce medical costs and improve quality of services. Treatments of acute promyelocytic leukemia at Rui-Jin Hospital, and childhood acute lymphoblastic leukemia at Shanghai Children’s Medical Center, can be taken as suitable models to illustrate the crucial role of Clinical Paths in guaranteeing clinical and cost effectiveness of medical services for critical diseases, and to satisfactorily justify the feasibility of DRGs in China.

关键词： healthcare reform     diagnosis-related groups     clinical paths     comparative effectiveness analysis     acute promyelocytic leukemia     childhood acute lymphoblastic leukemia    

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关于西部大开发对新疆工作的要求

刘守仁

《中国工程科学》 2000年 第2卷 第10期   页码 59-62

摘要：

新疆是我国西部的一个大省，生产建设兵团又以一种特殊的组织形式成为新疆的重要组成部分，新疆及兵团以其独特的地缘、人文、资源条件在西部开发中应当是大有作为的。新疆和生产建设兵团的开发要走出有自我特色之路，要加大环境保护力度，提髙作物光热资源利用和加速节水农业推广。观念转变是关键，人才开发是重点，而政府职能转变尤显重要，管理人才更是急需。农业要改变单纯的粮棉种植结构，大力提高畜牧业，特别是优质细毛羊在农业中的比重。西部大开发功在当代，利在千秋，注重近期效益与长远发展的结合，以保护群众积极参与的热情，促进战略目标的实现。

关键词： 西部开发     新疆     生产建设兵团    

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Unnormalized and normalized forms of gefura measures in directed and undirected networks

Raf GUNS,Ronald ROUSSEAU

《信息与电子工程前沿（英文）》 2015年 第16卷 第4期   页码 311-320 doi: 10.1631/FITEE.1400425

摘要： In some networks nodes belong to predefined groups (e.g., authors belong to institutions). Common network centrality measures do not take this structure into account. Gefura measures are designed as indicators of a node’s brokerage role between such groups. They are defined as variants of betweenness centrality and consider to what extent a node belongs to shortest paths between nodes from different groups. In this article we make the following new contributions to their study: (1) We systematically study unnormalized gefura measures and show that, next to the ‘structural’ normalization that has hitherto been applied, a ‘basic’ normalization procedure is possible. While the former normalizes at the level of groups, the latter normalizes at the level of nodes. (2) Treating undirected networks as equivalent to symmetric directed networks, we expand the definition of gefura measures to the directed case. (3) It is shown how Brandes’ algorithm for betweenness centrality can be adjusted to cover these cases.

关键词： Networks subdivided in groups     Partitions     Gefura measures     Q-measures     Brokerage role     Directed and undirected networks     Brandes’     algorithm    

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Decontamination of Cr(VI) facilitated formation of persistent free radicals on rice husk derived biochar

Kaikai Zhang, Peng Sun, Yanrong Zhang

《环境科学与工程前沿（英文）》 2019年 第13卷 第2期 doi: 10.1007/s11783-019-1106-7

摘要：

PFRs were produced on biochar during Cr(VI) decontamination.

PFRs formation on biochar was owing to the oxidization of phenolic-OH by Cr(VI).

Appearance of excessive oxidant led to the consumption of PFRs on biochar.

Biochar charred at high temperature possessed great performance to Cr(VI) removal.

关键词： Biochar     Persistent free radicals     Phenolic hydroxyl groups     Cr(VI) reduction    

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Distribution of phytoplankton community and its influence factors in an urban river network, East China

Ling Sun, Hui Wang, Yuanqing Kan, Shiliang Wang

《环境科学与工程前沿（英文）》 2018年 第12卷 第6期 doi: 10.1007/s11783-018-1062-7

摘要：

Effects of urban river conditions on phytoplankton community were investigated.

Nitrate utilization and hydrodynamic condition affected phytoplankton distribution.

A winter bloom was induced by abundant ammonia, total phosphorus and organic matters.

The diatoms and euglenoids dominated in an urban beheaded river ecosystem.

关键词： Phytoplankton composition     Spatiotemporal distribution     Functional groups     Nitrate nitrogen     Winter bloom    

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标题 作者 时间 类型 操作

Unravelling the bottleneck of phosphonic acid anchoring groups aiming toward enhancing the stability

期刊论文

Effects of functional groups for CO

Chenkai Gu, Yang Liu, Weizhou Wang, Jing Liu, Jianbo Hu

期刊论文

Experimental study on the progressive failure and its anchoring effect of weak-broken rock vertical slope

Hehua ZHU, Qianwei XU, Wenqi DING, Feng HUANG

期刊论文

Characterization and comparison of organic functional groups effects on electrolyte performance for vanadium

期刊论文

Influence of axial load on the lateral pile groups response in cohesionless and cohesive soil

Jasim M. ABBASA,Zamri CHIK,Mohd Raihan TAHA

期刊论文

Insight into the effect of surface carboxyl and amino groups on the adsorption of titanium dioxide for

Wenlong Zhang, Xuyang Zhao, Lin Zhang, Jinwei Zhu, Shanshan Li, Ping Hu, Jiangtao Feng, Wei Yan

期刊论文

Finite element prediction on the response of non-uniformly arranged pile groups considering progressive

Qian-Qing ZHANG, Shan-Wei LIU, Ruo-Feng FENG, Jian-Gu QIAN, Chun-Yu CUI

期刊论文

Novel precision piezoelectric step rotary actuator

LIU Jianfang, YANG Zhigang, ZHAO Hongwei, CHENG Guangming

期刊论文

Modeling oblique load carrying capacity of batter pile groups using neural network, random forest regression

Tanvi SINGH, Mahesh PAL, V. K. ARORA

期刊论文

中国岩石工程技术的新进展

钱七虎

期刊论文

Using sound Clinical Paths and Diagnosis-related Groups (DRGs)-based payment reform to bring benefits

Zhi-Ruo ZHANG PhD, Jian-Qing MI MD, Zhao-Jun WEN MA, Sai-Juan CHEN MD, PhD, Zhu CHEN PhD, Long-Jun GU MD, Jing-Yan TANG MD, PhD, Shu-Hong SHEN MD, PhD,

期刊论文

关于西部大开发对新疆工作的要求

刘守仁

期刊论文

Unnormalized and normalized forms of gefura measures in directed and undirected networks

Raf GUNS,Ronald ROUSSEAU

期刊论文

Decontamination of Cr(VI) facilitated formation of persistent free radicals on rice husk derived biochar

Kaikai Zhang, Peng Sun, Yanrong Zhang

期刊论文

Distribution of phytoplankton community and its influence factors in an urban river network, East China

Ling Sun, Hui Wang, Yuanqing Kan, Shiliang Wang

期刊论文