1995 and before

► X. Xu, X.Lu, N.Q. Wang, Q.E. Zhang, ‘Charge-Consistency Modelling of CO/NiO(100) Chemisorption System’, Chem. Phys. Letters, 235(1995)541-547.

►​ Xu Xin, Wang Nanqin, Lu Xin, Chen Mingdan and Zhang Qianer ‘Cluster-Surface Analogy: Ab Initio Calualtions on Pd Cluster’, Science in China, B25(6)(1995)573-578 (in Chinese). 徐昕、 王南钦、 吕 鑫、 陈明旦 、张乾二,“簇—表面类比:Pdn原子簇的从头算”,《中国科学》,B集,25(6)(1995)573-578.

►​ Xu Xin, Wang Nanqin, Lu Xin, Chen Mingdan and Zhang Qianer, ‘Convergence from the cluster to the surface: Ab initio calculations of Pdn clusters’.  Science in China, B38(9)(1995) 1038-1045.

►​ Xu Xin*, Wang Nanqin, Lu Xin, and Zhang Qianer, ‘Assignments for the Ground States of Metal Monocarbonyls’, Chin. Chem. Letters, 6(10)(1995) 887-890.

►​ Xu Xin*,Wang Nanqin .Lü Xin .and Zhang Qianer, ‘Ab Initio Studies of Pd2-CO cluster’, Chem. J. Chin. Univ.,.16(11)(1995)1775-1779.(in Chinese). 徐昕、 王南钦、  吕 鑫、 张乾二,“ Pd2-CO 簇的从头算研究”, 《高等学校化学学报》, 16(11)(1995).1775-1779.

►​ Lu Xin, Xu Xin ,Wang Nanqin and Zhang Qianer, ‘DV-X Embedded Cluster Studies: Chemisorptions of CO on NiO(100) Surface’, J. Xiamen Univ.(Natur.), 34(1995)952-959.(in Chinese). 吕 鑫,徐昕,王南钦,张乾二,“ CO在NiO(100) 表面吸附的DV—Xα嵌入簇模型研究”,《厦门大学学报》,34(1995)952-959

►​ Xu Xin*, Wang Nanqin, Lu Xin, and Zhang Qianer ‘Ab Initio Calculations on Pdn-CO Clusters’, Acta Chimica Sinica, 53(7)(1995)670-676 (in Chinese). 徐昕、 王南钦、 吕 鑫、张乾二,“ Pdn-CO(n=1-7) 原子簇的从头算”,《化学学报》,53(7)(1995)670-676.

►​ XU Xin, LU Xin, WANG Nanqin, ZHANG Qianer, ‘Cluster Simulations: Theoretical Studies of NiO and CO Chemisorption’. J. Natural Gas Chem. 4(4)(1995)353-364.

►​ Lu Xin, Xu Xin ,Wang Nanqin and Zhang Qianer, ‘DV-X Embedded Cluster Studies on Chemisorptions of CO,NO and O2 on NiO(100) Surface’, Chem. J. Chin. Univ., 16(3)(1995)424-427 (in Chinese). 吕 鑫、徐昕、 王南钦、张乾二,“ NiO(100) 表面小分子(CO,NO,O2)吸附的DV—Xα嵌入簇模型研究”,《高等学校化学学报》,16(1995)424-427.

►​ Lu Xin, Xu Xin ,Wang Nanqin and Zhang Qianer, ‘DV-Xα Embedded Cluster Studies: Chemisorptions of Oxygen Species on NiO(100) Surface’, Chem. J. Chin. Univ.,.16(10)(1995) 1757-1760. (in Chinese). 吕 鑫,徐昕,王南钦,张乾二,“ 氧物种在NiO(100) 表面吸附的DV—Xα嵌入簇模型研究”,《高等学校化学学报》,16(10)(1995)1757-1760.

►​ Lu Xin, Xu Xin ,Wang Nanqin and Zhang Qianer, ‘DV-Xa Embedded Cluster Studies: Chemisorptions of NO on NiO(100)  Surface’, Acta Physico-Chimica Sinica, 11(9)(1995)796—800.(in Chinese). 吕 鑫,徐昕,王南钦,张乾二,“ NO在NiO(100) 表面吸附的DV—Xα嵌入簇模型研究”,《物理化学学报》,11(9)(1995)796—800.

 

►​ X. Xu, N.Q. Wang and Q.E. Zhang, ‘Cluster Model Studies on the Chemisorptions on Metal Surfaces’, Chemistry, 4(1994)21-24 (in Chinese). 徐昕、 王南钦、 张乾二,“金属上化学吸附的簇模型量子化学研究”,《化学通报》,进展与评述(特邀稿),4(1994)21-24 .

►​ Xu Xin*, Wang Nanqin, Chen Mingdan and Zhang Qianer, ‘Studies on Cluster-Surface Analogy-- Cluster Model Calculations for CO/Pd Chemisorption System’, J. Natural Gas Chem., 3(1994)1-13.

►​ Xu Xin*,Wang Nanqin .Lü Xin and Zhang Qianer, ‘Ab Initio Studies of 1+ Ni-CO Cluster’, Chem. J. Chin. Univ., 15(10)(1994)1534-1537.(in Chinese). 徐昕、 王南钦、 吕 鑫、 张乾二,“1+ Ni-CO 分子簇的从头算研究”, 《高等学校化学学报》, 15(10)(1994)1534-1537.

►​ Xu Xin*,Wang Nanqin .Lü Xin and Zhang Qianer, ‘Ab Initio Studies of 3+ ,3, 3 Ni-CO Cluster’, Chem. J. Chin. Univ, 15(12)(1994)1821-1824. (in Chinese). 徐昕、 王南钦、  吕 鑫、 张乾二,“ 3+ ,3, 3  Ni-CO 分子簇的从头算研究”, 《高等学校化学学报》, 15(12)(1994)1821-1824.

►​ Xu Xin*, Wang Nanqin, Lü Xin and Zhang Qianer, ‘Ab Initio Studies of metallic Ni-CO’, J. Xiamen Univ.(Natur.), 33(6)1994, 823-826 (in Chinese). 徐昕、 王南钦、  吕 鑫、 张乾二,“Ni-CO 金属态簇的从头算研究”, 《厦门大学学报》(自然科学版), 33(6)(1994)823-826.

 

►​ X. Xu*, N.Q. Wang and Q.E. Zhang, ‘Studies on Cluster-Surface Analogy: Cluster Model Calculations for L/Ni(L=CN,CO,NO) Chemisorption Systems’, J. Mol. Struct., (Theochem) 280 (1993) 161-168.

 

►​ N.Q. Wang, X. Xu* and Q.E. Zhang, ‘Studies on the 'Cluster-Surface Analogy': Metallic Slater Basis Sets for Ab Initio Calculations of Chemisorption’, J. Mol. Struct.(Theochem)262(1992)105-116.

►​ X. Xu*, N.Q. Wang and Q.E. Zhang, ‘Studies on Cluster-Surface Analogy: Ab Initio Calculations for the CO/Ni Chemisorption System’, Surf. Sci.,274(1992)378-385.

►​ X. Xu*, N.Q. Wang and Q.E. Zhang, ‘Studies on Cluster-Surface Analogy: Ab Initio Calculations for the CO/Cu Chemisorption System’, Surf. Sci.,274(1992)386-392.

 

►​ X. Xu*, N.Q. Wang and Q.E. Zhang, ‘DVX Study of Ethylene Adsorbed on Ni(100) Surface and Nickel-Graphite Intercalation Compound’,  J. Mol. Struct., 247(1991)93-106.

 

X. Xu, N.Q. Wang and Q.E. Zhang, ‘DVX Study of Acetylene, Ethylene Adsorbed on Iron-Graphite Intercalation Compounds’, J. Catal., 11(1990)159-165.(in Chinese). 徐昕、 王南钦、 张乾二, “乙炔、乙烯在铁石墨嵌合物上吸附的DVX研究” ,《催化学报》,11(1990)159-165.

 

►​ X. Xu, N.Q. Wang and Q.E. Zhang, ‘DVX Study on the Interactions between Ethylene and Graphite Intercalation Compounds with Copper’, Chem. Res. Appl., 1(1989)36-42 (in Chinese). 徐昕、 王南钦、 张乾二, “乙烯和铜石墨嵌合物相互作用的DVX研究”,《化学研究与应用》,1(1989)36-42.