| 姓 名 | 刘文剑 | 性 别 | 男 | 出生年月 | 1966-00 |
|---|---|---|---|---|---|
| 所在院校 | 北京大学 | 所在院系 | 化学与分子工程学院 | ||
| 职称 | 教授 | 招生专业 | 物理化学（含：化学物理） | ||
| 研究领域 | 量子化学、相对论量子化学 |
| 联系方式 | 电 话 | 邮 编 | |
|---|---|---|---|
| 地 址 |
| 个人简介 |
| 刘文剑，1966年生。北京大学化学学院长江学者特聘教授。聘任岗位：理论化学。研究方向：量子化学，相对论量子化学。博士生导师。刘文剑，1966年生。北京大学化学学院长江学者特聘教授。聘任岗位：理论化学。研究方向：量子化学，相对论量子化学。博士生导师。 |
| 著作及论文 |
| W. Liu, G. Hong, D. Dai, L. Li, and M. Dolg, The Beijing 4-component density functional program package (BDF) and its application to EuO, EuS, YbO, and YbS, Theor. Chem. Acc. 97, 75 (1997). W. Liu, M. Dolg, and P. Fulde, Low-lying electronic states of lanthanocenes and actinocenes: M(C8H8)2 (M = Nd, Tb, Yb, U), J. Chem. Phys. 107, 3584 (1997). W. Liu and M. Dolg, Benchmark calculations on lanthanide atoms: calibration of ab initio and density functional methods, Phys. Rev. A 57, 1721 (1998). W. Liu, M. Dolg, and L. Li, Fully relativistic density functional calculations on the ground and excited states of Yb, YbH, YbF, and YbO, J. Chem. Phys. 108, 2886 (1998). W. Liu and Ch. van Wüllen, Spectroscopic constants of Eka-gold compounds: the importance of spin-orbit coupling, J. Chem. Phys. 110, 3730 (1999). W. Kutzelnigg and W. Liu, Relativistic MCSCF by means of quasi-degenerate direct perturbation theory. I. Theory, J. Chem. Phys. 112, 3540 (2000). W. Liu, Ch. van Wüllen, Y.-K. Han, Y.-J. Choi, and Y.-S. Lee, Spectroscopic constants of Pb and Eka-lead compounds: comparison of different approaches, Adv. Quantum Chem. 39, 325 (2001). W. Liu, Ch. van Wüllen, F. Wang, and L. Li, Spectroscopic constants of MH and M2 (M = Tl, E113, Bi, E115): direct comparison of four- and two-component approaches in the framework of relativistic density functional theory, J. Chem. Phys. 116, 3626 (2002).W. Liu, G. Hong, D. Dai, L. Li, and M. Dolg, The Beijing 4-component density functional program package (BDF) and its application to EuO, EuS, YbO, and YbS, Theor. Chem. Acc. 97, 75 (1997). W. Liu, M. Dolg, and P. Fulde, Low-lying electronic states of lanthanocenes and actinocenes: M(C8H8)2 (M = Nd, Tb, Yb, U), J. Chem. Phys. 107, 3584 (1997). W. Liu and M. Dolg, Benchmark calculations on lanthanide atoms: calibration of ab initio and density functional methods, Phys. Rev. A 57, 1721 (1998). W. Liu, M. Dolg, and L. Li, Fully relativistic density functional calculations on the ground and excited states of Yb, YbH, YbF, and YbO, J. Chem. Phys. 108, 2886 (1998). W. Liu and Ch. van Wüllen, Spectroscopic constants of Eka-gold compounds: the importance of spin-orbit coupling, J. Chem. Phys. 110, 3730 (1999). W. Kutzelnigg and W. Liu, Relativistic MCSCF by means of quasi-degenerate direct perturbation theory. I. Theory, J. Chem. Phys. 112, 3540 (2000). W. Liu, Ch. van Wüllen, Y.-K. Han, Y.-J. Choi, and Y.-S. Lee, Spectroscopic constants of Pb and Eka-lead compounds: comparison of different approaches, Adv. Quantum Chem. 39, 325 (2001). W. Liu, Ch. van Wüllen, F. Wang, and L. Li, Spectroscopic constants of MH and M2 (M = Tl, E113, Bi, E115): direct comparison of four- and two-component approaches in the framework of relativistic density functional theory, J. Chem. Phys. 116, 3626 (2002). |