武志堅,是一位研究員。
簡歷
1.教育簡歷1982.9 – 1986.6:吉林大學物理學院原子與分子物理專業,學士1986.9 – 1989.6:吉林大學物理系光學專業,碩士學位1997.9 – 2000.6:長春應用化學研究所,博士學位2. 工作經歷。
研究領域
計算材料學。
科研項目
(1)中國科學院留學經費擇優支持回國工作基金:稀土和過渡元素功能材料設計和性質預測研究。
(2)吉林省科技廳項目:新波段激光晶體研制開發。
(3)加拿大Killam基金會:Computational study of 脫氧核糖核酸protein cross-links。
(4)國家自然科學基金面上項目:新型類鈣鈦礦結構化合物的理論設計與實驗合成。
(5)國家自然科學基金面上項目:5d過渡金屬氮化物的晶體結構及彈性性質第一性原理研究。
代表論著
1.Cheng L., Wang J. P., Wang M. Y., Wu Z. J.,* Theoretical studies on the reaction mechanism of oxidation of primary alcohols by Zn/Cu(II)-phenoxyl radical catalyst. Dalton Transactions
2.Wang M. Y., Cheng L., Hong B., Wu Z. J.,* Reaction Mechanism of 鈀Catalyzed Silastannation of Allenes by Density Functional Theory. Journal of Computational 化學
3. Wang M. Y., Cheng L., Hong B., Wu Z. J.,* Regioselective Bis-selenation of Allenes Catalyzed by Palladium Complex: A Theoretical Study. Organometallics
4. Song W. Y., Zhao E. J., Meng J., Wu Z. J.,* Near compensated half metal in Sr2NiOsO6. Journal of Chemical Physics
5. Xiang H. P., Wu Z. J.,* Ab initio study on the electronic, magnetic and mechanical properties of CaCu3V4O12. Inorganic 化學
6. Wang M. Y., Cheng L., Wu Z. J.,* Theoretical studies on the reaction mechanism of Palladium(0)-catalyzed addition of thiocyanates to alkynes. Dalton Transactions
7. Xiang H. P., Liu X. J., Zhao E. J., Meng J., Wu Z. J.,* First-principles study on the conducting mechanism of the heavy-fermion system CaCu3Ru4O12. Physical Review B
8. Xiang H. P., Liu X. J., Zhao E. J., Meng J., Wu Z. J.,* Ferrimagnetic and half-metallic CaCu3Fe4O12: Prediction from first principles investigation. Applied Physics Letters
9. Wu Z. J.,* Hao X. F., Liu X. J., Meng J., Structures and elastic properties of OsN2 investigated via first-principles density functional calculation. Physical Review
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