Personal Information
Professor Supervisor of Doctorate Candidates Supervisor of Master's Candidates
Paper Publications
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[121]
D. Peng
and W. Liu*,
Exact two-component Hamiltonians revisited,
J. Chem. Phys.
2009,
131,
031104.
-
[122]
W. Liu*,
Y. Xiao,
and L. Cheng,
Four-component relativistic theory for NMR parameters: Unified formulation and numerical assessme...,
J. Chem. Phys.
2009,
130,
144102.
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[123]
W. Liu*,
J. Ma,
and D. Peng,
On the construction of Kramers paired double group symmetry functions,
Int. J. Quantum Chem.
2009,
109,
2149-2167.
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[124]
V. Staemmler,
W. Liu*,
W. Zou,
D. Peng,
J. Ma,
and W. Xu,
Excited states of ReO4-: A comprehensive time-dependent relativistic density functional theory st...,
Chem. Phys.
2009,
356,
219-228.
-
[125]
W. Liu*
and W. Zou*,
Comprehensive ab initio calculation and simulation on the low-lying excited states of TlX (X = F,...,
J. Comput. Chem.
2009,
30,
524-539.
-
[126]
W. Liu*
and W. Kutzelnigg*,
Matrix formulation of direct perturbation theory of relativistic effects in a kinetically balance...,
Chem. Phys.
2008,
349,
133-146.
-
[127]
Z. Wang,
Q. Zhou,
W. Liu,
N. Song*,
and J. Deng,
Towards near-infrared chiroptically switching materials: Theoretical and experimental studies on ...,
ChemPhysChem.
2008,
9,
1265-1269.
-
[128]
刘文剑*,
Principles of relativistic quantum chemistry and time-dependent relativistic density functional t...,
《理论化学原理与应用》（帅志刚，邵久书等编著；科学出版社，北京）
2008,
68-109.
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[129]
L. Cheng,
Y. Xiao,
W. Liu*,
and D. Peng,
Making four- and two-component relativistic density functional methods fully equivalent based on ...,
J. Chem. Phys.
2007,
127,
104106.
-
[130]
刘文剑*,
New Progress in Relativistic Quantum Chemistry,
化学进展
2007,
19,
833-851.