中德微结构联合实验室

 

Publications : 2012

 

 

350. Wang Wenlei, Dewen Zeng, Yong Du, and Qiyuan Chen, "Crystallization behavior of Calcium sulfate in the hydrometallurgical process of heavy metals and their related solubility phase diagrams",Scientia Sinica Chimica, in press (2010).

349. Shu-Sheng Liu, Li-Xian Sun, Jian Zhang, Yao Zhang, Fen Xu, Yong-Heng Xing, Fen Li, Jijun Zhao, Yong Du, Wang-Yu Hu, Hui-Qiu Deng. “Hydrogen storage properties of destabilized MgH2–Li3AlH6 system”.Inter. J. Hydro. Energy, In Press, Corrected Proof, Available online 4 February 2010

348. Chun-Hong Jiang, Li-Fang Song, Cheng-Li Jiao, Jian Zhang, Li-Xian Sun, Fen Xu, Yong Du, Zhong Cao. “Exceptional thermal stability and thermodynamic properties of lithium based metal-organic framework”,Journal of Thermal Analysis and Calorimetry, p 1-8, 2010, in Press.

347. Li-Fang Song, Chun-Hong Jiang, Cheng-Li Jiao, Jian Zhang, Li-Xian Sun, Fen Xu, Qing-Zhu Jiao, Yong-Heng Xing, Yong Du, Zhong Cao,Feng-Lei Huang. “Heat capacities and thermodynamic properties of one manganese-based MOFs”, Journal of Thermal Analysis andCalorimetry, p 1-6, 2010, in Press.

346. Li-Fang Song, Cheng-Li Jiao, Chun-Hong Jiang, Jian Zhang, Li-Xian Sun, Fen Xu, Qing-Zhu Jiao, Yong-Heng Xing, F.L. Huang, Yong Du,Zhong Cao, Fen Li, Jijun Zhao. “Heat capacities and thermodynamic properties of MgNDC”, Journal of Thermal Analysis and Calorimetry, p 1-8, 2010, Article in Press

345 Chun-Hong Jiang, Li-Fang Song, Jian Zhang, Li-Xian Sun, Fen Xu, Fen Li, Qing-Zhu Jiao, Zhen-Gang Sun, Yong-Heng Xing, Yong Du, Ju-Lan Zeng, Zhong Cao. “Thermodynamic properties and heat capacities of Co (BTC)1/3 (DMF) (HCOO)”, Journal of Thermal Analysis andCalorimetry, p 1-7, 2010, Article in Press.

344. S.L. Cui, L.J. Zhang, W.B. Zhang, Yong Du and H.H. Xu, "Computational study of diffusivities in diamond Ge-Si alloys,'" J. Min. Metall. Sect.B - Metall.,48(2) 227-249 (2012).

343. D. Živković, Yong Du, L. Balanović, D. Manasijević, D. Minić and N.Talijan, "Prediction of thermodynamic properties for liquid Al-Mg-Zn alloys," Mater. Technol., 46(5)  477-82 (2012).

342. Cai Tang, Biao Hu, Yong Du, Dongdong Zhao, Peng Zhou, Feng Zheng,Qiannan Gao, and Jiong Wang, "Thermodynamic modeling of the Hf-Sn andSn-Y systems," CALPHAD, 39, 91-96(2012).

341. Chong Chen, Zhongjian Zhang, Yaru Wang, Tao Xu, Jianzhan Long, Yong Du, and Dragana Zivkovic," Thermodynamic calculations of the Al-C-W and Al-C-Ni systems," pp. 553-556 in 44th International October Conference on Mining and Metallurgy, Edited by A. Kostov and M. Ljubojev. October 1 to 3, 2012, Bor, Serbia.

340. C. Tang, P. Zhou, D.D. Zhao, X. M. Yuan, Y. Tang, P. S. Wang, B. Hu, Yong Du, and H. H. Xu, "Thermodynamic modeling of the Sc-Zn system coupled with first-principles calculation", J. Min. Metall. Sect.B-Metall., 48(1) 123-130(2012).

339. Xu Fang, Yong Du, Min Song, Kai Li, and Chao Jiang, "Effects of Cu content on the precipitation process of Al-Zn-Mg alloys," J. Mater. Sci., 47, 8174-87 (2012).

338. S. L. Shang, D. E. Kim, C. L. Zacherl, Y. Wang, Yong Du, and Z. K. Liu, "Effects of alloying elements and temperature on elastic properties of dilute Ni-base superalloys from first-principles calculations," J. Appl. Phys., 112, 053515/1-10(2012).

337. Guangwei Zhao, Xinzhong Li, Daming Xu, Jingjie Guo, Hengzhi Fu, Yong Du, and Yuehui He, "Thermo-Calc based multi-component micro-segregation model and solidification paths calculations, " Research and development,9(3) 269-274 (2012).

336. Guangwei Zhao, Xinzhong Li, Daming Xu, Jingjie Guo, Hengzhi Fu, Yong Du, and Yuehui He, "Numerical computations for temperature, fraction of solid phase and composition couplings in ternary alloy solidification with three different thermodynamic data-acquisition methods, " CALPHAD, 36, 155-162 (2012).

335. Guangwei Zhao, Xinzhong Li, Daming Xu, Jingjie Guo, Hengzhi Fu,Yuehui He, and Yong Du, "Influence of heat treatment on morphology and quantity of eutectic phases of Al alloys with different cooling rates," Chin. J. Nonferrous Met. , 22, 343-349 (2012).

334. Guangwei Zhao, Xinzhong Li, Daming Xu, Jingjie Guo, Hengzhi Fu, Yong Du, and Yuehui He, "Thermo-Calc and T-fs-CL coupling based method to determine solidification paths of alloys solidified under condition of Biot ≤0.1,"Trans. Nonferrous Met. Soc. China, 22, 139-146 (2012).

333. Aijun Wang, Shun-Li Shang, Yong Du, Li Chen, Jianchuan Wang, and Zi-Kui Liu, "Effects of pressure and vibration on thermal decomposition of cubic Ti1-xAlxN, Ti1-xZrxN and Zr1-xAlxN coatings: A first-principles study," J. Mater. Sci., 47, 7621-27(2012)

332. L.J. Zhang, A. Markström, P. Mason, Yong Du, S.H. Liu, L. Kjellqvist, J. Bratberg, Q. Chen, and A. Engström," TCAL1 and MOBAL2 The development and validation of new thermodynamic and mobility databases for aluminum alloys," 13th International Conference on Aluminum Alloys (ICAA13), Edited by H. Weiland, A.D. Rollett, and W.A. Cassada, TMS, USA (2012).

331. Kai Li, Min Song, Yong Du, and Xu Fang," Effect of minor Cu addition on the precipitation sequence of an as-cast Al-Mg-Si 6005 alloy," Arch. Metall. Mater., 57, 457-467 (2012).

330. Weimin Chen, Tao Xu, Weibin Zhang, Hao Zhang, Yong Du, ChengyuTan, Li Chen, Zhongjian Zhang, and Xiangzhong Liu, "Computer simulation of gradient zone formation in cemented carbides and its experimental verification," The Chinese Journal of Nonferrous Metals, 22(5) 1440-47 (2012).

329. Xiaoming Yuan, Lijun Zhang, Yong Du, Wei Xiong, Ying Tang, AijunWang, and Shuhong Liu, "A new approach to establish both stable and metastable phase equilibria for fcc ordered/disordered phase transition: application to the Al-Ni and Ni-Si systems," Materials Chemistry and Physics, 135, 94-105 (2012).

328. Shuhong Liu, Bengt Hallstedt, Denis Music, and Yong Du," Ab initio calculations and thermodynamic modeling for the Fe-Mn-Nb system,"CALPHAD, 38, 43-58 (2012).

327. Weihua SunSenlin CuiLijun ZhangYong Du, and Baiyun Huang, "Phase-field simulation of microstructural evolution of γ precipitate in γ′matrix in binary Ni-Al Alloys," Procedia Engineering, 36, 200-206(2012).

326. Chong Chen, Man Wang, Yong Du, Qiannan Gao, Biao Hu, and Yong Du, "Thermodynamic modeling of the Sr-X (X=H,Li,Na,Sc) systems," CALPHAD, 38, 17-22 (2012).

325. Qiannan Gao, Yong Du, Dongdong Zhao, Aijun Wang, Jiong Wang,Shuhong Liu, and Yifang Ouyang, "Elastic, phonon and thermodynamic properties of Mg-Ga compounds from first-principles calculations," CALPHAD, 37, 137-144 (2012).

324. S. L. Shang, W. Y. Wang, Y. Wang, Yong Du, J. X. Zhang, A. D. Patel, and Z. K. Liu, "Temperature-dependent ideal strength and stacking fault energy of fcc Ni: A first-principles study of shear deformation," J. Phys. Condens.Matter., 24,155402-10 pp(2012). 

323. Man Wang, Weihua Sun, Chunsheng Sha, Biao Hu, Yong Du, Linxin Sun,Honghui Xu, Jianchuan Wang, and Shuhong Liu, "Thermodynamic modeling of the LiH and CaH systems," J. Phase Equilib. Diffu., 33(2) 89-96 (2012).

322. Aijun Wang, ShunLi Shang, Dongdong Zhao, Jiong Wang, Li Chen, Yong DuZi-Kui Liu, Tao Xu and Shequan Wang, "Structural, phonon and thermodynamic properties of fcc-based metal nitrides from first-principles calculations," CALPHAD, 37, 126-131(2012).

321. Y.J. Liu, D. Yu, Yong Du, G. Sheng, Z.H. Long, J. Wang, and L.J. Zhang, "Atomic mobilities, diffusivities and their kinetic implications for U-X (X= Ti, Nband Mo) bcc alloys, " CALPHAD, 37, 49-56 (2012).

320. Kaiming Cheng, Biao Hu, Yong Du, Honghui Xu, and QiannanGao,"Thermodynamic modeling of the Ge-Sc system supported by key experiments and first-principles calculation," CALPHAD, 37, 18-24(2012).

319. Yaru WangPeisheng WangDongdong ZhaoBiao Hu, Yong Du,Honghui Xu, Keke Chang, "Thermodynamic description of the GeNa andGeK systems using the CALPHAD approach supported by first-principles calculations," CALPHAD, 37, 72-76 (2012).

318. Peng Zhou, Shuhong Liu, Peisheng Wang, Honghui Xu, Yingbiao Peng,Xiaoming Yuan, Yong Du, Jun Zhang, and Weidong Huang, "Experimental investigation and thermodynamic assessment of the Hf-Mn system," J. PhaseEquilib. Diff., 33(1)20-28 (2012).

317. Kaiming Cheng, Biao Hu, Yong Du, Honghui Xu, and Qiannan Gao,"Thermodynamic modeling of the Ge-Sc system supported by key experiments and first-principles calculation", CALPHAD, 37, 18-24 (2012).

316. X.M. Tao, Y.Z. Liu, R.C. Wang, Y.F. Ouyang, Yong Du and Y.H. He, "First-principles investigations of elastic, electronic and thermodynamic properties of Al12X(X = Mo, W,and Re)", Intermetallics, 24, 15-21(2012).

315. Shaoqing Wang, Peng Zhou, Weibin Zhang, Senlin Cui, Lijun Zhang, Ming Yin, Dandan Liu, Honghui Xu, Shuhong Liu, and Yong Du, "Atomic mobility and diffusivity of bcc_A2 phase in the FeX (X=Cu, Si, Zn) systems",CALPHAD, 36, 127-134(2012).

314. Lijun Zhang, Yong Du, Honghui Xu, and Jingrui Zhao, "Thermodynamic description of the Mn-Si-Zn system", Science China-Technological Sciences, 55 (2) 475-483 (2012).

313. Ailing Zhu, Jianchuan Wang, Yong Du, Dongdong Zhao, andQiannan Gao, "Effect of Zn impurities on the electronic properties of Prdoped CaTiO3", Physica B, 407, 849-854 (2012).

312. Yong Du, Lijun Zhang, Senlin Cui, Dongdong Zhao, Dandan Liu,Weibin Zhang,  Weihua Sun, and Wanqi Jie, "Atomic mobilities and diffusivities in Al alloys", Science China-Technological Sciences, 55 (2) 306-328 (2012).

311. Jingrui Zhao, Yong Du,  Lijun Zhang Aijun Wang Liangcai Zhou, Dongdong Zhaoand Jianlie Liang, "Thermodynamic assessment of theSn-Sr system supported by first-principles calculations", ThermochimicaActa, 529, 74-79 (2012).

310. Ying Tang, Yong Du, Lijun Zhang, Xiaoming Yuan, and GeorgeKaptay, "Thermodynamic description of the Al-Mg-Si system using a new formulation for the temperature dependence of the excess Gibbs energy",Thermochimica Acta, 527, 131-142(2012).