中北大學(xué)

任君，博士，副教授，2007年畢業(yè)于中國(guó)科學(xué)院山西煤炭化學(xué)研究所，獲物理化學(xué)(含化學(xué)物理)博士學(xué)位。之后到德國(guó)Chemnitz工業(yè)大學(xué)做高級(jí)訪問學(xué)者，從事鈦硅分子篩催化反應(yīng)相關(guān)研究�；貒�(guó)后，作為主要參加者參與了國(guó)家自然科學(xué)基金項(xiàng)目(基金號(hào)：20473111,20590360,20573127)；參與完成中科院“百人計(jì)劃”和中國(guó)科學(xué)院山西煤炭化學(xué)研究所創(chuàng)新基金項(xiàng)目；參與了國(guó)家863計(jì)劃項(xiàng)目“能源領(lǐng)域中的關(guān)鍵問題”的研究工作。

研究方向包括：

1、利用量子化學(xué)計(jì)算軟件包(Material Studio，VASP等計(jì)算軟件),應(yīng)用密度泛函理論研究模型催化劑α-Mo2C、γ-Mo2N、MoP、Ni2P的電子結(jié)構(gòu)及其表面性質(zhì)，并以CO、噻吩等為吸附模型分子研究表面吸附活性位及吸附行為，從而對(duì)其加氫反應(yīng)機(jī)理進(jìn)行初步研究；

2、從事含能材料的分子設(shè)計(jì)、模擬計(jì)算研究；

3、乙腈催化加氫生產(chǎn)乙胺反應(yīng)機(jī)理研究；

4、碳一化學(xué)相關(guān)反應(yīng)機(jī)理研究等；

5、甲醇下游產(chǎn)品聚甲氧基二甲醚的工藝技術(shù)開發(fā)。

近幾年發(fā)表主要論文：

 (1) Jun Ren, Chun-Fang Huo, Jianguo Wang, Yong-Wang Li, Haijun Jiao. Surface structure and energetics of oxygen and CO adsorption on α-Mo2C(0001).

Surface Science, 2005, 596, 212-221.

(2) Jun Ren, Chun-Fang Huo, Jianguo Wang, Yong-Wang Li, Haijun Jiao. Density functional theory study into the adsorption of CO2, H and CHx (x = 0-3) as well as C2H4 on α-Mo2C(0001) Surface Science, 2006, 600, 2329-2337.  

(3) Jun Ren, Chun-Fang Huo, Xiao-dong Wen, Zhi Cao, Jianguo Wang, Yong-Wang Li, Haijun Jiao. Thiophene Adsorption and Activation on MoP(001), γ-Mo2N(100), and Ni2P(001) Surfaces: ab initio Periodic Density Functional Theory Study  J. Phys. Chem. B 2006, 110, 22563 - 22569.

(4) Jun Ren, Chun-Fang Huo, Xiao-Dong Wen, Zhi Cao, Shuping Yuan, Jianguo Wang, Yongwang Li, Haijun Jiao. Adsorption of NO, NO2, pyridine and pyrrole on α-Mo2C(0001): A DFT Study Surface Science, 2007, 601,1599-1607.

(5) Jun Ren, Jian-guo Wang, Zhang-feng Qin, Jun-fen Li, Yong-wang, Li. Density Functional Theory Study into Crystal Chemistry of Nickel Phosphides Journal of Fuel Chemistry and Technology, 2007, 4:p458-464..

(6) Xiao-Dong Wen, Jun Ren, Yong-Wang Li, Jianguo Wang, Haijun Jiao. NO adsorption on triangular Mo28S60 cluster. Chem. Phys. Lett. 2007, 436,209-212.

(7) Chun-Fang Huo, Jun Ren, Yong-Wang Li, Jianguo Wang and Haijun Jiao. CO Dissociation on Clean and Hydrogen Pre-covered Fe(111) Surfaces.J. Catal. 2007, 249，172-182.

(8) Ren, Fu-de, Jun Ren, Liu, Sheng-nan, Yue, Yuan, Wang, Wen-liang, Chen, Shu-sen, A UB3LYP and UMP2 theoretical investigation on unusual cation-pi interaction between the triplet state HB=BH ((3)Sigma(-)(g) and H+, Li+, Na+, Be2+ or Mg2+ (vol 16, pg 615, 2010) , Journal of Molecular Modeling, 17(5), pp 1223-1226, 2011/5.

(9) Xu, Wen-zheng, Ren, Fu-de, Jun Ren, Liu, Sheng-nan, Yue, Yuan, Wang, Wen-liang, Chen, Shu-sen, A UB3LYP and UMP2 theoretical investigation on unusual cation-pi interaction between the triplet state HB=BH (3 Sigma(-)(g)) and H+, Li+, Na+, Be2+ or Mg2+ ,Journal of Molecular Modeling, 16(4), pp 615-627, 2010/4.

(10) Ma, Dong-xu, Ren, Fu-de, Hu, Tuo-ping, Jun Ren,Theoretical investigation on the structures and thermodynamic properties of mixed boron-, nitrogen- and oxygen-containing three- and four-membered rings BnNmOHp (n=0-3, m=0-3, p=0-3) ,Journal of Molecular Structure (Theochem), 942(1-3), pp 121-130, 2010/2/28.

(11) Liu Sheng-Nan, Cao Duan-Lin, Ren Fu-De, Jun Ren, Theoretical Investigations on the Structures and Properties of the Side-on Complexes B(2)(N(2))(2) and Monocyclic B(n)(N(2))(n)(m) (n=3 similar to 6, m =-1 similar to+2) ,Chinese Journal of Structural Chemistry, 29(10), pp 1459-1466, 2010.

(12) Hu, Tuo-ping, Ren, Fu-de, Jun Ren,Theoretical investigation on geometries and aromaticity of mixed boron-, nitrogen- and furanoxo-containing five-membered rings B2N2OHp (p=0-2),Journal of Molecular Structure (Theochem), 909(1-3), pp 13-18, 2009/9/15.

(13) Ren, Fu-de, Cao, Duan-lin, Wang, Wen-liang, Jun Ren, Hou, Su-qing, Chen, Shu-sen, A theoretical study on unusual intermolecular T-shaped X-H center dot center dot center dot pi interactions between the singlet state HB=BH and HF, HCl, HCN or H2C2 , Journal of Molecular Modeling, 15(5), pp 515-523, 2009/5.

(14) 陳麗珍，張琳，任福德，曹端林，任君, Theoretical Studies on Intermolecular Hydrogen-bond Interactions between Hexamethylenetetramine and Nitric Acid, 結(jié)構(gòu)化學(xué), 2013,1: P7-16.

(15) 劉勝楠，曹端林，任福德，任君, Theoretical Investigations on the Structures and Properties of the Side-on Complexes B2（N2）2 and Monocyclic Bn（N2）nm （n=3～6,m=-1～+2）, 結(jié)構(gòu)化學(xué), 2010 ,10: P1459-1466.

(16) 韓新艷， 任君， 曹端林， 朱佳平，Acetonitrile （CH3 CN） and methyl isocyanide （CH3 NC） adsorption on Pt （111） surface：a DFT study. 測(cè)試科學(xué)與儀器(英文版), 2013, 1:97-102.

(17)朱佳平，任君，韓新艷，李永祥，王建龍，曹端林用密度泛函理論研究多硝基吡嗪氮氧化物的結(jié)構(gòu)和爆轟性能,火炸藥學(xué)報(bào),2010,6:P47-52.

(18)儀建紅，胡雙啟，劉勝楠，曹端林，任君,硝基吡唑類衍生物的結(jié)構(gòu)和爆轟性能的理論研究,含能材料,2010,3:P252-256

(19)杜栓麗，王晶禹，何爽，朱佳平，任君，胡志勇，曹端林可用于乳化炸藥的Gemini表面活性劑水溶液聚集形態(tài)模擬研究含能材料2011,19(1):p28-32.

(20)楊俊召，任君，賈廣信，陶濤，宋法恩,改性Hβ沸石在甲醇汽油催化改性中的應(yīng)用和表征,石油化工,2011,2:P146-150.

(21)楊濤，溫曉東，任君，李永旺，王建國(guó)，霍春芳,Fe3O4(111),(110)和(001)表面結(jié)構(gòu)的密度泛函理論研究(英文),燃料化學(xué)學(xué)報(bào),2010,1:P121-128.

(22)辛振東，李巧玲，任君，賈秀梅,HCN在Ni(111),Ni(100)和Ni(110)面吸附的密度泛函理論研究,中北大學(xué)學(xué)報(bào)(自然科學(xué)版),2012,6:P709-715.

(23)韓新艷，朱佳平，王勇，曹端林，任君，王建龍,鈍感材料PATO及其衍生物熱穩(wěn)定性質(zhì)研究,中北大學(xué)學(xué)報(bào)(自然科學(xué)版),2013,1:P45-51.