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Journal of the American Chemical Society
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October 31, 2002
[Ni(0)L]-catalyzed cyclodimerization of 1,3-butadiene: a density functional investigation of the influence of electronic and steric factors on the regulation of the selectivity
Sven Tobisch, Tom Ziegler
Journal of the American Chemical Society
|
June 20, 2002
Stochastic simulations of polymer growth and isomerization in the polymerization of propylene catalyzed by Pd-based diimine catalysts
Artur Michalak, Tom Ziegler
The Journal of Chemical Physics
|
October 29, 2005
A simplified relativistic time-dependent density-functional theory formalism for the calculations of excitation energies including spin-orbit coupling effect
Fan Wang, Tom Ziegler
Journal of the American Chemical Society
|
April 25, 2002
[Ni(0)L]-catalyzed cyclodimerization of 1,3-butadiene: a comprehensive density functional investigation based on the generic [(C(4)H(6))(2)Ni(0)PH(3)] catalyst
Sven Tobisch, Tom Ziegler
Inorganic Chemistry
|
March 14, 2013
A theoretical analysis of supported quintuple and quadruple chromium-chromium bonds
Sylvester Ndambuki, Tom Ziegler
Chirality
|
September 17, 2010
A theoretical study on the exciton circular dichroism of propeller-like metal complexes of bipyridine and tripodal tris(2-pyridylmethyl)amine derivatives
Jing Fan, Tom Ziegler
Chirality
|
February 5, 2008
On the origin of circular dichroism in trigonal dihedral d6 complexes of bidentate ligands containing only sigma-orbitals. A qualitative model based on a density functional theory study of Lambda-[Co(en)3]3+
Jing Fan, Tom Ziegler
The Journal of Chemical Physics
|
October 9, 2007
Formulation of magnetically perturbed time-dependent density functional theory
Michael Seth, Tom Ziegler
The Journal of Chemical Physics
|
August 24, 2010
On the calculation of charge transfer transitions with standard density functionals using constrained variational density functional theory
Tom Ziegler, Mykhaylo Krykunov
The Journal of Chemical Physics
|
March 4, 2005
The performance of time-dependent density functional theory based on a noncollinear exchange-correlation potential in the calculations of excitation energies
Fan Wang, Tom Ziegler
Page
of 11
Search research articles
Search
Showing results (1-10 of 108) with videos related to
Sort By:
Page
of 11
Journal of the American Chemical Society
|
October 31, 2002
[Ni(0)L]-catalyzed cyclodimerization of 1,3-butadiene: a density functional investigation of the influence of electronic and steric factors on the regulation of the selectivity
Sven Tobisch, Tom Ziegler
Journal of the American Chemical Society
|
June 20, 2002
Stochastic simulations of polymer growth and isomerization in the polymerization of propylene catalyzed by Pd-based diimine catalysts
Artur Michalak, Tom Ziegler
The Journal of Chemical Physics
|
October 29, 2005
A simplified relativistic time-dependent density-functional theory formalism for the calculations of excitation energies including spin-orbit coupling effect
Fan Wang, Tom Ziegler
Journal of the American Chemical Society
|
April 25, 2002
[Ni(0)L]-catalyzed cyclodimerization of 1,3-butadiene: a comprehensive density functional investigation based on the generic [(C(4)H(6))(2)Ni(0)PH(3)] catalyst
Sven Tobisch, Tom Ziegler
Inorganic Chemistry
|
March 14, 2013
A theoretical analysis of supported quintuple and quadruple chromium-chromium bonds
Sylvester Ndambuki, Tom Ziegler
Chirality
|
September 17, 2010
A theoretical study on the exciton circular dichroism of propeller-like metal complexes of bipyridine and tripodal tris(2-pyridylmethyl)amine derivatives
Jing Fan, Tom Ziegler
Chirality
|
February 5, 2008
On the origin of circular dichroism in trigonal dihedral d6 complexes of bidentate ligands containing only sigma-orbitals. A qualitative model based on a density functional theory study of Lambda-[Co(en)3]3+
Jing Fan, Tom Ziegler
The Journal of Chemical Physics
|
October 9, 2007
Formulation of magnetically perturbed time-dependent density functional theory
Michael Seth, Tom Ziegler
The Journal of Chemical Physics
|
August 24, 2010
On the calculation of charge transfer transitions with standard density functionals using constrained variational density functional theory
Tom Ziegler, Mykhaylo Krykunov
The Journal of Chemical Physics
|
March 4, 2005
The performance of time-dependent density functional theory based on a noncollinear exchange-correlation potential in the calculations of excitation energies
Fan Wang, Tom Ziegler
Page
of 11