苏克和


苏克和

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苏克和【苏克和】苏克和教授,1984年7月本科毕业于四川大学化学系化学专业,获理学学士学位;1987年7月研究生毕业于四川大学化学系物理化学专业,获理学硕士学位;1987年7月到西北工业大学任教至今;1993年3月-1994年6月被派往美国Eastern Illinois University进修;1996-1999年于西北大学现代物理研究所“理论物理”专业攻读博士学位(在职),2001年获理学博士学位 。
基本介绍中文名:苏克和
国籍:中国
出生日期:1962年生
毕业院校:四川大学化学系化学专业
个人简介苏克和,男,1962年生,理论物理博士,教授,博士生、硕士生导师 。专业领域:物理化学、材料物理与化学 。曾赴美国Eastern Illinois University进修,访问学者 。主持和主要参加的国家自然科学基金4项,主要参加国防973项目1项,主持其他国家级、省部级科学基金3项,发表科研论文80余篇,其中SCI收录30余篇;获得省部级科学技术一等奖1项,省部级教学成果奖2项;主持建设省级“精品课程”1门、省级实验教学示範中心1个 。主要科研方向为:物理化学,量子化学理论、方法与套用,套用量子化学与分子设计,材料物理与化学 。工作履历、荣誉主讲本科生《普通化学》、《物理化学》、《化学热力学与动力学》;研究生《物质结构基本原理》、《量子化学》、《群论》;博士生《现代物质结构研究方法导论》等课程;参加国家级、省级和校级教学研究项目共5项;与胡小玲教授共同主编出版国防“十五”重点规划教材《物理化学》、《现代化学分析技术》(高教出版社)、《现代仪器分析智慧型仿真》系列(7部,高教出版社)等教材;主持建成(2003年)陕西省精品课程–《普通化学》,担任我校基础化学实验教学中心主任,2007年通过陕西省级实验教学示範中心评审 。主要研究课题有CVD/CVI製备SiC的气相反应机理研究、芳香烃在CVD/CVI製备SiC材料中的产生和作用机理研究、自癒合陶瓷基複合材料基础研究 。主持国家自然科学基金,陕西省自然科学基金3项,主要参加国家自然科学基金2项,参加国防“973”项目1项;在J. Comp. Chem., Chem. Phys. Lett., Theor. Chem. Acc., Chem. Phys., J. Phys. Chem. Ref. Data, Polymer, Chem. Vap. Dep., J. Mol. Struc.(Theochem), Comput. Mat. Sci.,《中国科学》、《化学学报》、《物理学报》、《物理化学学报》及《化学物理学报》等国内外着名刊物发表学术论文80余篇,SCI收录50余篇 。获陕西省人民政府教学成果一等奖和二等奖各1项,陕西省科学技术一等奖、省教育厅科技进步奖一、二等奖各1项 。主持的主要科研项目2009-2012,参加国家自然科学基金(重点)“超细晶材料在高温、高应变率下的力学行为”(10932008)2006-2009,国防973“xxx陶瓷基複合材料基础研究”––主持专题3.12006-2008,主持国家自然科学基金“CVD/CVI製备SiC的气相反应机理研究”(50572089)1998-2000,参加国家自然科学基金“多参考态二级微扰理论程式的研製和套用”(29773035)2001-2003,参加国家自然科学基金“空穴–粒子对偶和后HF程式的并行化”(20073032)1997-1998,主持陕西省自然科学基金“热化学数据的精确模型化学计算与评价”2000-2002,主持陕西省自然科学基金“精确模型化学计算方法研究”主要出版物1.苏克和,C. A. Deakyne, 量子化学的Gaussian-2理论及其套用与化合物的…,化学进展, 1995,7(2): 1282.苏克和,C. A. Deakyne, 氖(Ne)和氩(Ar)原子的SP型弥散函式,原子与分子物理学报, 1995,12(1): 1073.苏克和,C. A. Deakyne, T. J. Tegeler, 等电子、等自旋与非等旋反应的…,物理化学学报, 1995,11(4):2924.苏克和,C. A. Deakyne, J. F. Liebman, 某些离解能、电子亲和能等的…,物理化学学报,1995,11(10): 8655.苏克和,文振翼,胡小玲,李秀仪,王育彬,NH2-30-1+离解能等的高级ab…,物理化学学报,1996,5: 3856.苏克和,C A Deakyne, J F Liebman, Systematic Discrepancy of the …,原子与分子物理学报,1996,13(4): 5227.苏克和,李秀仪,吴雄等,化学反应焓变的量子化学理论计算,化学通报,1996, 4: 508.吴雄,苏克和,氧化锡表面的原子簇模型计算,物理化学学报,1996,12(4):3579.吴雄,苏克和,程永清,氧在SnO2(110)面吸附机理的研究,感测技术学报,1996,2:610.丁涪江,张良辅,苏克和,HNNH3的从头计算研究, 物理化学学报,1996,12(11): 100611.Kehe Su, Xiaoling Hu, Xiuyi Li, Yubin Wang, Zhenyi Wen, Chem. Phys. Lett., 1996, 258: 431.12.苏克和,C A Deakyne, J F Liebman, G2 Prediction of …,原子与分子物理学报,1997, 14(1): 13613.苏克和,甘正汀,胡小玲,李秀仪等,PH2-30-1+离解能等的精确ab…,化学物理学报,1997,10(4): 35214.Zhengting Gan, Kehe Su, Yubin Wang, Zhenyi Wen, Several Excited States …, Chem. Phys ., 1998, 228: 3115.苏克和,王育彬,文振翼,含芯电子相关能修正的G2理论G2(fu1),物理化学学报,1998,14(9):85616.齐斌,苏克和*,王育彬,文振翼,唐孝炎,Criegee中间体…,物理化学学报,1998,14(11):103317.甘正汀,苏克和,王育彬,文振翼,组态相互作用计算中藕合係数的…,中国科学(B),1998,28(5): 42118.李兆龙,苏克和,王育彬,文振翼,几个分子和负离子的QCI势能…,分子科学学报,1998,14(4):242 19.Z. Gan, Kehe Su, Y. Wang, Z. Wen, A method to fast determine the…, Science in China (B) , 1999, 42(1): 4320.Y Wang, Z Gan, K Su, Z Wen, An Adjustable Contracted CI Method, Science in China (B )., 1999, 42(6): 64921.Y Wang, Z Gan, K Su, Z Wen, An Improved Contracted CI Method, Chem. Phys. Lett. , 1999, 312: 27722.王育彬,甘正汀,苏克和,文振翼*, 可调节的收缩CI方法, 中国科学(B),1999,29(6): 48923.朱卡克,甘正汀,苏克和,王育彬,黄明宝,文振翼,CH自由基和NO2…,化学学报,2000, 58(5): 515-51824.Wang Yubin, Gan Zhengting, Kehe Su, Wen Zhenyi, Configuration-based multi-reference second order perturbation theory, Science in China (B), 2000, 43(6): 56725.苏克和,魏俊,胡小玲等,分子几何构型最佳化方法的系统性比较,物理化学学报,2000, 16(7): 64326.苏克和,魏俊, 胡小玲等,最佳化几何构型对高级别 ab initio 能量的影响,物理化学学报, 2000, 16(8): 71827.苏克和, 魏俊,胡小玲等,精确模型化学中MP n 微扰外推的一个问题,物理化学学报,2000, 16(10): 90428.苏克和,魏俊,胡小玲等,几种含芯电子相关能修正的G2理论,物理化学学报,2000,16 (11): 97229.苏克和,魏俊,胡小玲等,G3(QCI)模型化学方法,物理化学学报,2000,16(11). 100330.王育彬,甘正汀,苏克和,文振翼,基于组态的多参考态二级微扰理论,中国科学(B),2000, 30(6): 54331.文振翼,王育彬,甘正汀,苏克和,王鹤峰,多参考态二级微扰理论算法研究和程式实现,物理无机化学进展与前瞻,p194-198,陕西科学技术出版社,2000年9月32.甘正汀,苏克和,王育彬,文振翼,MRCISD程式的改进,化学学报,2000,58(11): 1471-147533.齐斌,苏克和,胡敏等,甲烷–空气–H2O模拟光化学反应体系·…,化学学报,2001,59(4): 610-61434.L. Hu, K. Su*, H. Yue, X. Wang, J. Deng, Z. Wen, Theoretical probe of the structure and properties of C n N2 n ( n ="2-5)" clusters, J. Mol. Struc.(Theochem), 756, 2005: 205-213 35.徐红,苏克和,车万锐,杨勇,陈新,文振翼,鲁米诺-二甲亚碸-氢氧…,化学学报,2006, 64(19): 1981-198736.张黄莉,耿兴国,李金山,苏克和等,氧含量对YBa2Cu3Ox…,稀有金属材料与工程,2006,35(6): 910-237.Q. Zeng, K. Su, L. Zhang, Y. Xu, L. Cheng, X. Tian, Evaluation of the Thermodynamic Data of CH3SiCl3 Based on Quantum Chemistry Calculations, J. Phys. Chem. Ref. Data, Vol. 35, No. 3, 2006: 1385-9038.Zhi-Yin Wang, Hui-Qing Fan*, Ke-He Su*, Zhen-Yi Wen, Structure and piezoelectric properties of poly(vinylidene fluoride) studied by density functional theory, Polymer, 47 (2006) 7988-799639.Z. Wang, K. Su*, H. Fan, L. Hu, X. Wang, Y. Li, Z. Wen, Properties of C60 under structure distortion studied with density functional theory, Computational Materials Science, 2007, 40(4): 537-54740.Zhiyin Wang, Daijun Liu, Kehe Su*, Huiqing Fan, Yulong Li, Zhenyi Wen, Properties of He@C60 studied via structure distortions, Chem. Phys., 2007, 331: 309-32041.Zhi-Yin Wang, Hui-Qing Fan*, Ke-He Su*, Xin Wang, Zhen-Yi Wen, Structure, phase transition and electric properties of poly(vinylidene fluoride-trifluoroethylene) copolymer studied with density functional theory, Polymer, 48 (2007) 3226-323642.Zhi-Yin Wang, Ke-He Su*, Hui-Qing Fan, Zhen-Yi Wen, Structure and electric properties of poly(vinylidene fluoride- tetrafluoroethylene) copolymer studied with density functional theory, Polymer, 48(24) 7145-7155 (2007)43.Xiaoping Yao, Kehe Su*, Juanli Deng, Xin Wang, Qingfeng Zeng, Laifei Cheng, Yongdong Xu, Litong Zhang, Gas-phase reaction thermodynamics in preparation of pyrolytic carbon by propylene pyrolysis, Computational Materials Science, 2007, 40(4): 504-524 44.Zhi-Yin Wang, Ke-He Su*, Hui-Qing Fan, Zhen-Yi Wen, Possible reasons that piezoelectricity has not been found in bulk polymer of polyvinylidene cyanide, Polymer, 49, (2008) 2542-254745.Z.Y. WANG, K.H. SU*, H.Q. FAN, Y.L. LI and Z.Y. WEN, Mechanical and electronic properties of endofullerene Ne@C60 studied via structure distortions, Molecular Physics, 106(5), 2008: 703-71646.Juanli Deng, Kehe Su*, Yan Zeng, Xin Wang, Qingfeng Zeng, Laifei Cheng, Litong Zhang, Investigation of thermodynamic properties of gaseous SiC(X 3Π and a 1Σ) with accurate model chemistry calculations, Physica A: Statistical Mechanics and its Applications, 387 (2008), pp. 5440-545647.Juanli Deng, Kehe Su*, Xin Wang, Qingfeng Zeng, Laifei Cheng, Yongdong Xu and Litong Zhang, Thermodynamic properties of the most stable gaseous small silicon-carbon clusters in their ground states, The European Phys. J. D, 49, 2008, 21-3548.Yan Zeng, Kehe Su*, Juanli Deng, Tao Wang, Qingfeng Zeng, Laifei Cheng, Litong Zhang, Thermodynamic investigation of the gas-phase reactions in the chemical vapor deposition of boron carbide with BCl3-CH4-H2 precursors, J. Mol. Struc. (THEOCHEM), 2008, 861, 103-11649.Tao Wang, Kehe Su*, Juanli Deng, Yan Zeng, Qingfeng Zeng, Laifei Cheng, Litong Zhang, Reaction thermodynamics in chemical vapour deposition of boron carbides with BCl3-C3H6(propene)-H2 precursors, J. Theor. Comput. Chem., 2008, 7(6), 1269-1312 50.Juanli Deng, Kehe Su*, Xiaoping Yao, Xin Wang, Qingfeng Zeng, Laifei Cheng, Yongdong Xu, Litong Zhang, Erratum to: “Gas-phase reaction thermodynamics in preparation of pyrolytic carbon by propylene pyrolysis” [Comput. Mater. Sci. 40 (2007) 504-524], Comput. Mater. Sci., 44 (2008) 838-84051.Zhang Limin, Geng Xingguo, Li Jinshan, Fu Hengzhi, Su Kehe, Zhou Lian, Calculations and analysis of superconducting energy gap and electronic specific heat in YBa2Cu3O7, Rare Metal Materials and Engineering, 2008, 37(2): 215-852.Juanli Deng, Kehe Su*, Xin Wang, Qingfeng Zeng, Laifei Cheng, Yongdong Xu and Litong Zhang, Thermodynamics of the gas-phase reactions in chemical vapor deposition of silicon-carbide with Methyltrichlorosilane precursor, Theor. Chem. Accounts, 2009, 122(1-2): 1-2253.Xiaojun Li, Kehe Su*, Structure, stability and electronic property of the gold-doped germanium clusters: AuGe n ( n ="2—13),Theoretical" Chemistry Accounts, 124(5), (2009), 345-35454.J. Deng, K. Su,* Q. Zeng, X. Wang, L. Cheng, Y. Xu, L. Zhang, Thermodynamics of the Production of Condensed Phases in the CVD of Methyltrichlorosilane Pyrolysis, Chem. Vap. Deposition, 2009, 15, 281-29055.Zhiyin Wang, Kehe Su, Lingxia Jin and Zhenyi Wen, Density functional theory study of structure and electric properties of poly(vinylidene cyanide tetrafluoroethylene) copolymer ultrathin film, LSFM: Soft Materials, 2009, 7(4): 296-318 56.Zhi-YinWANG, Ke-He SU, Xiao-Ping YAO, Yu-Long LI and FangWANG, Mechanical and electronic properties of endofullerene Ar@C60 and Kr@C60 studied via structure distortions, Materials Chemistry and Physics, 2010,119: 406-41757.Yena Qu, Kehe Su*, Xin Wang, Yan Liu, Qingfeng Zeng, Laifei Cheng, Litong Zhang, Reaction pathways of propene pyrolysis, J. Comp. Chem., 2010, 31(7): 1421-144258.Xiaoqiong Jiang, Kehe Su*, Xin Wang, Yanli Wang, Yan Liu, Qingfeng Zeng, Laifei Cheng, Litong Zhang, An investigation of the lowest reaction pathway of propene+BCl3 decomposition in chemical vapor deposition process, Theoretical Chemistry Accounts, 2010, 127(5-6), 519-53859.Zhi-YinWANG, Ke-He SU, Fang WANG, Zhenyi WEN, Density functional theory study of the structure and electric properties of poly(vinylidene cyanide trifluoroethylene) copolymer ultrathin film, Synthetic Metals, 160 (2010) 2341-235060.Yan Liu, Kehe Su*, Xin Wang, Yanli Wang, Qingfeng Zeng, Laifei Cheng, Litong Zhang, An ONIOM study of H2O interacting with the C-terminated surface of silicon carbide, Chem. Phys. Lett, 2010, 501: 87-9261.Deng, Juan Li; Cheng, Lai Fei; Hong, Zhi Liang; Su, Ke He, Thermodynamics on formation of condensed phases during CVD Si3N4 process with SiCl4-NH3-H2 precursors, Advanced Materials Research, 2011, 194-196: 1516-152362. Deng, Juan Li; Cheng, Lai Fei; Gao, Li Ning; Su, Ke He, The relationship between the initial gas ratios and the condensed phase composition in the CVD of BxC with CH4-H2 precursors, Advanced Materials Research, 2011, 239-242, 1761-1765 63.Peipei Han, Kehe Su*, Yan Liu, Yanli Wang, Xin Wang, Qingfeng Zeng, Laifei Cheng, Litong Zhang, J. Comp. Chem., 2011, 32(13): 2745-275564.Xin Wang, Kehe Su, Juanli Deng, Yan Liu, Yanli Wang, Qingfeng Zeng, Laifei Cheng, Litong Zhang, Initial decomposition of methyltrichlorosilane in the chemical vapor deposition of silicon-carbide, Computational and Theoretical Chemistry, 967 (2011) 265-27265.王艳丽,苏克和*,王欣,刘艳,超长( n , n )型碳纳米管的密度泛函理论研究,物理学报,2011,60(9): 098111-1~098111-7