Personal Information
Professor Supervisor of Doctorate Candidates Supervisor of Master's Candidates
Paper Publications
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[91]
I. Lindgren
and W. Liu*,
Going beyond `no-pair relativistic quantum chemistry',
J. Chem. Phys.
2013,
139,
014108.
-
[92]
J. Ma
and W. Liu*,
Theoretical study of low-lying excited states of molecular aggregates. I. Development of linear-s...,
Sci. China Chem.
2013,
56,
1263-1266.
-
[93]
W. Liu*
and Y. Xiao,
Body-fixed relativistic molecular Hamiltonian and its application to nuclear spin-rotation tensor...,
J. Chem. Phys.
2013,
139,
034113.
-
[94]
W. Liu*
and Y. Xiao,
Body-fixed relativistic molecular Hamiltonian and its application to nuclear spin-rotation tensor,
J. Chem. Phys.
2013,
138,
134104.
-
[95]
W. Liu*,
Y. Xiao,
Y. Zhang,
B. Suo,
and Z. Li,
Combining spin-adapted open-shell TD-DFT with spin-orbit coupling,
Mol. Phys.
2013,
111,
3741-3755.
-
[96]
L. Li,
F. Wang,
and W. Liu*,
The Beijing density functional (BDF) program package: Methodologies and applications,
J. Theor. Comput. Chem.
2013,
2,
257-272.
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[97]
H. Chen,
Q. Shi,
W. Liang,
W. Liu,
and Z. Shuai*,
Theoretical study of the low-lying electronic excited states for molecular aggregates,
Sci. China Chem.
2013,
56,
1258-1262.
-
[98]
W. Liu*,
Y. Xiao,
and Q. Sun,
Exact two-component relativistic theory for NMR parameters: General formulation and pilot applica...,
J. Chem. Phys.
2012,
137,
174105.
-
[99]
W. Liu*,
The `big picture' of relativistic molecular quantum mechanics, in Theory and Applications in Comp...,
AIP Conf. Proc.
2012,
1456,
62-66.
-
[100]
W. Liu*,
Special issue of Chemical Physics on recent advances and applications of relativistic quantum che...,
Chem. Phys.
2012,
395,
1.