• 电话:0531-88364464
  • 传真:0531-88564464
  • 地址:
    中国山东省济南市山大南路27号
  • 邮编:250100

导师风采

【个人简介】

【学习及工作经历】

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    教育经历

    1989.9-1993.6 山东建材学院,学士(分析化学)

    1995.9-1998.6 山东大学化学学院硕士研究生(胶体化学),导师:徐桂英教授

    2000.9-2003.6 山东大学化学与化工学院博士研究生(理论化学),导师:江元生院士

    工作经历

    1998.7-至今  山东大学化学与化工学院工作,先后聘为讲师(1999)、副教授(2003)、教授(2006)、博士生导师(2009)

    2004.1-2005.1 香港科技大学化学系,博士后。导师:严以京教授

    2007.3-2007.6 香港浸会大学化学系,访问学者。合作老师:郑元杰副教授

    2009.7-2009.9 德国Munster大学物理系,访问学者。老师:迟力峰教授

2013.7               加拿大Alberta大学化工系,访问学者。老师:徐政合教授 

 

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【主讲课程】

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  •  物理化学 (自1999年,大二本科生)
  • 分子模拟及其应用(自2005年,研究生)
  • 分子模拟实验(大三本科生)

【研究领域和兴趣】

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  •  分子模拟计算方面:
  • 1)表面活性剂体系:包括气液界面、体相、固体表面吸附等
  • 2)驱油体系:润湿反转、泡沫驱油、破乳、稠油降粘、PPG驱油等
  • 3)防污材料体系:贻贝蛋白等在固体表面的吸附等
  • 4)小分子水凝胶体系:Fmoc保护二肽分子、多肽分子等
  • 及粗粒、介观模拟,Monte Carlo方法等。
  • 实验方面:
  • 小分子水凝胶
  •  石墨烯凝胶体系
  • 表面活性剂体系

   

【主要论著】

        《分子模拟:理论与实验》,苑世领 张恒 张冬菊, 化工出版社 ,2016.10

【科研项目】

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    负责项目:
    2003.1-2004.12
    表面活性剂与聚合物相互作用的分子模拟研究,山东大学青年基金;

    2004.1-2006.12 介观模拟在两亲分子缔合体系中的应用,国家自然科学基金(20303011;

    2005.1-2006.12 胶体与界面化学教育部重点实验室开放课题;

    2006.1-2008.12 硅(111)表面单层自组装膜的性质研究,山东省优秀中青年基金(2006BS04005

    2007.1-2007.12 调剖机理研究, 胜利油田

    2008.1-2008.12 驱油用表面活性剂界面聚集形态, 胜利油田

    2008.1-2010.12 硅表面单层膜的摩擦性质研究,山东省自然科学基金(Y2007B09

    2009.1-2011.12 抗钙镁表面活性剂自组装结构的分子动力学模拟,国家自然科学基金(20873074

    2009.1-2011.12 缔合型减阻剂抗剪切机理的分子模拟,中石油

    2009.5-2010.12 耐温耐盐表面活性剂的分子设计,中国石油科技创新基金(2009D-5006-05-07)

    2009.1-2010.12 耐温耐盐泡沫驱油用表面活性剂的分子设计和机理研究,胜利油田

    2010.1-2011.12 表面活性剂的耐温耐盐性能与机理研究,胜利油田

    2010.1-2011.12 分子模拟相关参数及固液界面行为研究,胜利油田

    2011.1-2011.12 耐温耐盐表面活性剂与聚合物聚集结构的多尺度模拟,国家自然科学基金(21043008)

    2012.1-2015.12 耐温耐盐表面活性剂与聚合物聚集结构的多尺度模拟,国家自然科学基金(21173128)

    2012.1-2014.12 处理复杂化学体系的理论新方法及其应用研究,山东省自然科学基金重点项目(ZR2011BZ0003)

    2012.7-2014.12 新型类水滑石衍生复合物氧化物硫转移剂的制备与性能研究,中国石油科技创新基金(2012D-5006-0401)

  • 2013.1-2014.12 界面性能分子模拟及表面活性剂性能, 胜利油田

    2012.7-2014.6 防污材料表面双离子特性组装膜的分子模拟,中船重工(KF120404)

  • 2016.1-2019.12 泡沫驱油体系中表面活性剂聚集结构的多尺度模拟,国家自然科学基金(21573130)

  • 2015.9-2016.12 界面与体相性能及分子模拟测试,胜利油田

 

【科研成果】

 

2016

1. Guokui Liu, Heng Zhang, Gang Liu,  Shiling Yuan*, Chengbu Liu "Tetraalkylammonium interactions with dodecyl sulfate micelles: a molecular dynamics study" Phys. Chem. Chem. Phys. 2016, 18, 878-885

2. Han Zhang, Jichao Sun, Xia Xin*, Wenlong Xu, Jinglin Shen, Zhaohua Song, Shiling Yuan* "Modulating self-assembly behavior of a slat-free peptide amphiphile and zwitterionic surfactant mixed system" J. Colloid and interface Sci. 2016, 467, 43-50.

3. Heng Zhang, Ying Ma, Qingquan Hao, Hua Wang, Gang Liu, Shiling Yuan* "Molecular dynamics study on mechanism of performed particle gel transporting through nanopores: the effect of hydration layer" RSC Adv. 2016, 6, 7172-7180.

4. Jinglin Sheng, Jinyu Pang, Guiying Xu, Xia Xin*, Yingjie Yang, Xiaoyu Luan, Shiling Yuan* "Smart stimuli-responsive fluorescent vesicular sensor based on inclusion complexation of cyclodextrins wiht tyloxapol" RSC Adv. 2016, 6, 11683-11690

5. Han Zhang, Menghong Yu, Aixin Song, Yawen Song, Xia Xin* Jinglin Shen, Shiling Yuan* "Modulating hieratchical self-assembly behavior of a peptide amphiphile/nonionic surfactant mixed system" RSC Adv. 2016, 9186-9193

6. Hui Yan, Shiling Yuan* "Molecular dynamics simulation of the oildetachment process within silica nanopores" J. Phys. Chem. C 2016, 120, 2667-2674

7. Gang Liu, Heng Zhang, Guokui Liu, Shiling Yuan* A kinetic Monte Carlo simulation of organic particles hetero-patterning on template-induced surface, Colloids and surface A, 2016, 494: 186-193

8. Guokui Liu, Ruoxue Li, Yaoyao Wei, Fengfeng Gao, Honglei Wang, Shiling Yuan*, Chengbu Liu "Molecular dynamics simulaitons on tetraalkylammonium interactions with dodecyl sulfate micelles at the air/water interface" Journal of Molecular Liquid, 2016, 222, 1085-1090

9. Jinglin Shen, Xia Xin*, Teng Liu, Lu Tong, Guiying Xu, Shiling Yuan*, "Manipulation the properties of supramolecular hydrogels of cyclodextrin/Tyloxapol/carbon-based nanomaterials" J. Colloid and interface Sci. 2016, 468, 78-85

10. Han Zhang, Xia Xin*, Jichao Sun, Liupeng  Zhao, Jinglin Shen, Zhaohua Song, Shiling Yuan* "Self-assembled chiral helical nanofibers by amphiphilic dipeptide derived from D- or L-threonine and application as a template for the synthesis of Au and Ag nanoparticles" J. Colloid and interface Sci. 2016, 484, 97-106

11.  Ying Ma, Heng Zhang*, Qingquan Hao, Gang Liu, Hua Wang, Shiling Yuan* "Molecular dynamics study on mechanism of preformed particle gel transporting through nanopores: deformation and dehydartion" J. Phy. Chem. C.  2016, 120, 19389-19395

12. Jinglin Shen, Xia Xin*, Teng Liu, Shubin Wang, YIngjie Yang, Xiaoyu Luan, Guiying Xu, Shiling Yuan*. "Ionic self-assembly of a Giant vesicle as a smart microcarrier and microreactor" Langmuir 2016, 32, 9548-9556

13. Guokui Liu, Yaoyao Wei, Fengfeng Gao, Shiling Yuan*, Chengbu Liu, "Origins of entropy change for the amphiphilic molecule in micellization : a molecular dynamics study" Phys. chem. chem. phys. 2016, 18, 11357-11361

14. Gang Liu, Heng Zhang, Guokui Liu, Shiling Yuan*, Qingzeng Zhu, "a kinetic Monte Carlo simulaiton of centrer shift on template -induced surface" Colloid Surface A, 2016, 509, 401-407

15. Yaoyao Wei, Honglei Wang, Goukui Liu, Zhongni Wang, Shiling Yuan* "a molecular dynamics study on two promising green surfactant micelles of choline dodecyl sulfate and laurate" RSC Adv. 2016, 6, 84090-84097

16. Yaoyao Wei, Guokui Liu, Zhongni Wang, Shiling Yuan* "Molecular dynamics study on the aggregation behaviour of different positional isomers of sodium dodecyl benzenesulphonate" RSC Adv. 2016 , 6 49708-49716

17. 马莹 张恒 苑世领 分子模拟研究醇醚类表面活性剂耐盐机理 山大学报 2016, 517(7)126-130.

 

 

 

 

2015年

1. Jichao Sun, Heng Zhang, Kai Guo, Shiling Yuan* "Self-assembly of dipeptide sodium salts derived from alanine: a molecular dynamics study" RSC Adv. 2015, 5, 102182-102190.

2. Lin Wang, Xia Xin*, Mengzhou Yang, Jinglin Shen, Shiling Yuan* "Incorpooration of graphene oxide into C12E4/C12mimBr hybrid lyotropic liquid crystal and ist thermo-sensitive properties" RSC Adv. 2015, 5, 68404-68412.

3. Lin Wang, Xia Xin*, Mengzhou Yang, Xin Ma, Jinglin Shen, Zhaohua Song, Shiling Yuan* "Effects of graphene oxide and salinity on sodium deoxycholate hydrogels and their applications in dye absorption" colloids and sufaces A, 2015, 4783, 112-120

4. Gang Liu, Heng Zhang, Wenchong Wang, Shiling Yuan* "A kinetic Monte Carlo simulaiton fo surface microfluidic patterning organic molecules based on anisotropic wetting" Chem. Phys. Letters, 2015, 628, 54-59

5. Hui Yan Shiling Yuan*, Suyuan Zeng, Meiju Niu* "The mechanism of selective deposition of luminescent molecules onto self-assembled mnolayers using molecular dynamics" Applied surface science, 2015, 349, 163-168

6. 刘刚 张恒 苑世领* 刘成卜 Monte Carlo模拟研究有机分子的模板诱导定位沉积 中国科学 2015, 45(10):

7 马莹 张恒 苑世领* 部分水解的预交联凝胶型聚丙烯酰胺的水化层结构 高等学校化学学报 2015, 36(2), 386-394

8. 郭凯 张恒 孙继超 苑世领 刘成卜 Fmoc-FF 二肽分子自组装过程的分子动力学研究 高等学校化学学报 2015,36(11):2171-2178

 

 

2014

1. Peili zhang, Zhen Xu, Qian Liu, Shiling Yuan* "Mechanism of oil detachment from hybrid hydrophobic and hydrophilic surface in aqueous solution" J. Chem. Phys. 2014, 140, 164702.

2.Fengfeng Gao, Hui Yan, Qiwei Wang, Shiling Yuan* "Mechanism of foam destructuion by antifoams: a molecular dynamics study". Phys. Chem. Chem. Phys. 2014, 16, 17231-17237

3. Heng Zhang, Gang Liu, Wenchong Wang, Lifeng Chi, Shiling Yuan* "Step-edge induced area selective growth: a kinetic Monte Carlo study" RSC Adv. 2014, 4, 25005-25010

4. Lin Wang, Xia Xin*, Kai Guo, Mengzhou Yang, Shiling Yuan* "Ordered carbon nanotubes-n-dodecyl tetraethylene monoether liquid crystal composites through phase separation induced by poly(ethylene glycol)". Phys. Chem. Chem. Phys. 2014, 16, 14771-14780

5. Lin Wang, Xia Xin*, Mengzhou Yang, Shiling Yuan* "Comparative study of n-dodecyl tetraethylene monoether lyotropic liquid crystals incorporated with grapheme and grapheme oxide". Phys. Chem. Chem. Phys. 2014, 16, 20932-20940

6.Hua Wang, Heng Zhang, Shiling Yuan*,Chengbu Liu, Zhen Xu* "Molecular dynamics study of the adsorption of anionic surfactant in a nonionic polymer brush". J. Mol. Model. 2014,20, 2267

7.Haitao Kang, Congyun Zhang, Kai Lv, Shiling Yuan* "Surfactant-assisted synthesis and catalytic activity for Sox abatement of high-surface-area CuMgAlCe mixed oxides". Ceramics International, 2014, 40, 5357-5363

8. Baoruo Li, Shiling Yuan* "Synthesis, Characterization, and evaluation of TiMgAlCu mixed oxides as novel SOx removal catalysts". Ceramics International, 2014, 40, 11559-11566

9. Hua Wang, Heng Zhang, Shiling Yuan*. Molecular dynamics study of the structure of an oppositely charged polyelectrolyte and an ionic surfactant at the air/water interface. Colloid and Surface A, 2014, 454, 104-112

10. Fen Wang, Yanbo Song, Baoshuo Li, Rong Fan, Guiyun Jin, Shiling Yuan* “C and N stable isotope analysis of human and animal bones at the Beiqian site”. Science China (Earth Science), 2014, 57, 408-414

11. 张恒 胡丽梅 蔺存国 王利 苑世领* 溶菌酶蛋白与聚合物防污膜相互作用的分子动力学模拟 高分子学报 2014,1, 99-106

12. 胡丽梅 蔺存国 王利 苑世领* 溶菌酶蛋白在聚合物防污膜表面的吸附  物理化学学报 2014,30(11)2149-2156

13. Fengfeng Gao, Zhen Xu, Guokui Liu, Shiling Yuan* Molecular dynamics simulation : The behavior of asphaltene in crude oil and at the oil/water interface, Energy and fuels, 2014, 28, 7368-7376

 

2013

1. Heng Zhang, Hua Wang, Guiying Xu, Shiling Yuan* "A molecular dynamics simulaiton of N-(fluorenyl-9-methoxycarbonyl) -depeptides supramolecular hydrogel" Colloid and Surfaces A: 2013, 417, 217-223

2. Congyun Zhang, Hui Yan, Kai Lv, Shiling Yuan* "Facile synthesis of hierarchically porous silica nanocapsules and nanoshperes via vesicel templating" Colloid and Surfaces A, 2013, 424, 59-65

3. Congyun zhang, Zhen Xu, Hui Yan, Fengfeng Gao, Shiling Yuan* "Deposition behavior onto different template structures and step-edge induced area-selective growth of rubrene: a molecular dynamics study" Chem. Phys. Letters, 2013,

4. Haitao Kang, Kai Lv, Shiling Yuan* "Synthesis, Characterization, and SO2 removal capacity of MnMgAlFe mixed oxides derived from hydrotalcite-like compounds" Apolied Clay Sci. 2013, 72: 184-190

5. Enze Li, Zhiping Du, Shiling Yuan* "Properties of a water layer on hydrophhilic and hydrophobic self-assembled monolayer surfaces: a molecular dynamics study" Sci. China Chem. 2012, 56: 773-781

6. 延辉 徐振 陈玉 苑世领* “分子动力学模拟研究荧光分子芘在磺基甜菜碱胶束中的增溶中国科学 化学 2013, 43: 1-9 

7. 张恒 王华 蔺存国 王利 苑世领* “聚合物防污材料表面水化层的分子动力学模拟化学学报 2013, 71:649-656

8. Congyun Zhang, Chuan Du, Hui Yan, Shiling Yuan*, Lifeng Chi* "Influence of self-assembled monolayers on Growth and crystallization of rubrene films: a molecular dynamics study" RSC advance, 2013, 3, 15404-15410.

9. Fengfeng Gao, Hui Yan, Shiling Yuan* Fluorescent probe solubilised in cetyltrimethylammonium bromide micelles by molecular dynamics simulation. Molecular simulation, 2013, 39, 1042-1051

10. 苑世领 康海涛 张丛筠 吕凯 一种催化裂化再生烟气硫转移剂及其制备方法 中国专利(ZL 201110029268.4,授权日2013.6.19

 

2012

5. Qian Liu, Shiling Yuan*, Hui Yan, Xian Zhao* "Mechanism of oil detachment from a silica surface in aqueous surfactant solutions: molecular dynamics simulations" J. Phys. Chem. B 2012, 116(9): 2867-2875

4. Hui Yan, Peng Cui, Chengbu Liu, Shiling Yuan* "Molecular dynamics simulation of pyrene solubilized in a sodium dodecyl sulface micelle" Langmuir, 2012, 28,4931-4938

3. Kai Lv, Haitao Kang, Heng Zhang, Shiling Yuan* "Molecular simulaiton studies for interaction of photoactive dyes into layered double hydroxide" Colloid and Surfaces A: 2012, 402, 108-116

2. Hua Wang, Heng Zhang, Chengbu Liu,  Shiling Yuan* "Coarse-grained molecular dynamics simulaiton of self-assembly of polyacrylamide and sodium dodecylsulfate in aqueous soluiton" Journal of Colloid and interface science: 2012, 386, 205-211

1. 程玉桥 延辉 张继超 苑世领* "钙离子对表面活性剂单层膜聚集结构的影响" 中国科学(化学):2012, 42(7): 1097-1104

0. 即墨北阡遗址人骨稳定同位素分析:沿海先民的食物结构. 2012, 57(12): 1037-1044.

0. “Reconstructing the food structure of ancient coastal inhabitants from Beiqian village: stable isotopic analysis of fossial human bone”,  Chinese science bulletin, 2012, 57(17): 21482154.

 

2011.

8. Congyun Zhang, Haitao Kang, Kai Lv, Hui Chen, Shiling Yuan*  "Maize phytoliths and photoluminescent silica nanotubes prepared from a natural silica resource" Ind. Eng. Chem. Res. 2011, 50, 12521-12526

7. Xinli Guo, Shouhong Yang,  Shiling Yuan*   Mesoscale simulation on patterned core-shell nanosphere model for amphiphilic block copolymer.  Colloids and surfaces A, 2011, 384, 212-218.  

6. Zhen Xu, Ke Song,  Shiling Yuan*,  Chenbu Liu*   Microscopic wetting of self-assembled monolayers with different surfaces: a combined molecular dynamics and quantum mechanics study.   Langmuir 2011, 27,8611-8620.  

5. Hui Yan, Xinli Guo, Shiling Yuan*, Chengbu Liu Molecular Dynamics study of the effect of calcium ions on the monolayer of SDC and SDSn surfactant at the vapoer/liquid interface.  Lanmguir 2011, 27, 5762-5771.

4. Zhen Xu, Michael Hirtz, Shiling Yuan*, Chenbu Liu, Lifeng Chi* Elective deposition of organic molecules onto different densely packed self-assembled monolayers: a molecular dynamics study.  Chemical Physics Letters, 2011, 507,138-143.

3. Zhen. Xu, Shiling Yuan*, Hui, Yan, Chengbu Liu*, Adsorption of histidine and histidine-containing peptides on Au(111): a molecular dynamics study.   Colloids and Surfaces A, 2011, 380, 135-142.

2. 李振泉 延辉 宋新旺 苑世领* 基甜菜碱两性表面活性剂的结构性质.   化学学报 2011, 69, 898-904.  

1. 吕凯 康海涛 苑世领*   二苯并噻吩直接加氢脱硫过程的理论研究   石油炼制与化工 2011, 42(7): 85-90.  

0. 陈辉 林立 石元昌 苑世领* “小麦中植硅体形态的初步研究与分类 东方考古, 2011,7,341-350.

0. 康海涛 苑世领* “山东白陶佛教造像样品检测分析报告,山东白陶佛教造像中的第四章,文物出版社,P25-30

 

2010

 5. Hui Yan, Shiling Yuan*, Guiying Xu, Chenbu Liu  Effect of Ca2+ and Mg2+ ions on surfactant solutions investigated by molecular dynamics simulation   Langmuir 2010, 26(13): 10448-10459.  

 4. S. Yuan, H. Yan, K. Lv, C. Liu, S. L. Yuan*, Surface behavior of a model surfactant: A theoretical simulation study.  Journal of Colloid and Interface Scicence 2010, 348, 159-166.

3. Shouhong Yang, Yuenkit Cheng, Shiling Yuan* Mesoscale simulation on patterned nanotube model for amphiphilic block copolymer  Journal of Moecular Modelling. 2010, 16,1819-1824.

 2. H. Chen, F. Wang, C. Zhang, Y. Shi, G. Jin, S. L. Yuan*, Preparation of nano-silica naterials: the concept from wheat straw.  Journal of Non-Crystalline Solid, 2010, 356, 2781-2785.

1. 曹绪龙 吕凯 苑世领* 阴离子表面活性剂与阳离子的相互作用   物理化学学报 2010261959-1964  

2009
3. Shiling Yuan*, Xiuqing Zhang, KwongYu Chan Effects of Shear and Charge on Microphase Formation of P123 Polymer in the SBA-15 Synthesis Investigated by Mesoscale Simulations Langmuir 2009, 25(4), 2034-2045.

2. 李振泉 郭新立 苑世领* 阴离子表面活性剂在油水界面聚集的分子动力学模拟 物理化学学报, 2009, 25(1), 6-12.

1. 崔鹏 苑世领* 徐桂英 玉米植株中的植硅石及其纳米SiO2的制备 无机材料学报, 2009, 24(3), 512-516.

2008
4. Hui Yan, Shiling Yuan*, Gang Liu Theoretical calculation on the reaction of alkene molecules on H-Terminated Si(100)-3*1 surface Molecular Simulation, 2008,34(5):525-531.

3. Shouhong Yang, Xiuqing Zhang, Shiling Yuan* Mesoscopic simulation studies on micellar phases of Pluronic P103 solution Journal of Molecular Modelling, 2008, 14, 607-620.

2. Shouhong Yang, Shiling Yuan*, Xiuqing Zhang, Yijing Yan Phase behavior of tri-block copolymers in solution: Mesoscopic simulation study Colloids and Surfaces A, 2008, 322, 87-96.

1. 延辉 苑世领* 刘成卜 烯烃分子在氢终止Si(100)-2*1表面的自由基链反应 物理化学学报, 2008, 24, 8-12.

2007

2. Haihui Jiang, Shiling Yuan*, Gang Liu Theoretical study on reactions of alkene molecules on H-terminated Si(111): Density functional theory and ab initio molecule dynamics Chemical Physical Letters  2007, 438, 53-58.

1. 张秀青 苑世领* 徐桂英 刘成卜 水溶液中Pluronic嵌段共聚物聚集行为的介观模拟

物理化学学报, 2007, 23, 139-144.

 

2006

6. Xiuqing Zhang, Shiling Yuan*, Jian Wu Mesoscopic simulation on phase behavior of ternary copolymeric solution in the absence and present of shear Macromolecules, 2006, 39, 6631-6642.

5. Jinxin Guo, Sixiu Sun, Shiling Yuan* Computer Simulations of Extractant Primary Amine N1923 and N1923 Hydrochloride Salt at Water/ Chloroform Interface Molecular Simulation, 2006, 32, 451-455.

 4. 苑世领* 崔鹏 徐桂英 刘成卜 气液界面上阴离子表面活性剂单层膜的分子动力学模拟化学学报,200664(16), 1659-1664.

3. Shiling Yuan*, Lixia Ma, Xiuqing Zhang, Liqiang Zheng Molecular Dynamics Studies on Monolayer of Cetyltrimethylammonium Bromide Surfactant Formed at the Air/Water Interface Colloids and Surfaces A: 2006, 289:1-9.

2.Shiling Yuan*, Yijian Chen, Guiying Xu  Molecular dynamics studies on octadecyl ammonium chloride at the air/liquid interface Colloids and Surfaces A, 2006, 280: 108-115.

1. Shiling Yuan*, Xiuqing Zhang, Guiying Xu, Dongju Zhang Mesoscopic simulation study on a weakly charged block p[olyelectrolyte in aqueous solution J. Mol. Model 2006, 12:406-410

【所获专利】

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【联合培养情况】

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【拟招收研究生情况】

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