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Tom Ziegler

Showing results (51-60 of 108) with videos related to

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Journal of the American Chemical Society|April 17, 2003
A theoretical study of the large Hg-Hg spin-spin coupling constants in Hg(2)(2+), Hg(3)(2+), and Hg(2)(2+)-crown ether complexesJochen Autschbach, Ciprian D Igna, Tom Ziegler
The Journal of Physical Chemistry. A|July 13, 2006
The influence of solvation and finite temperatures on theWittig reaction: A theoretical studyMichael Seth, Hans Martin Senn, Tom Ziegler
The Journal of Chemical Physics|November 18, 2011
Calculation of the exchange coupling constants of copper binuclear systems based on spin-flip constricted variational density functional theoryHristina R Zhekova, Michael Seth, Tom Ziegler
Journal of the American Chemical Society|January 20, 2005
On the origin of optical activity in tris-diamine complexes of Co(III) and Rh(III): a simple model based on time-dependent density function theoryFrancisco Elias Jorge, Jochen Autschbach, Tom Ziegler
Inorganic Chemistry|February 25, 2009
A theoretical study of the magnetic circular dichroism spectrum for sulfite oxidase based on time-dependent density functional theoryElizabeth Hernandez-Marin, Michael Seth, Tom Ziegler
Inorganic Chemistry|January 23, 2010
Density functional theory study of the electron paramagnetic resonance parameters and the magnetic circular dichroism spectrum for model compounds of dimethyl sulfoxide reductaseElizabeth Hernandez-Marin, Michael Seth, Tom Ziegler
Inorganic Chemistry|June 4, 2010
Density functional theory study of the magnetic circular dichroism spectra of molybdenyl complexesElizabeth Hernandez-Marin, Michael Seth, Tom Ziegler
The Journal of Physical Chemistry. A|September 8, 2009
Implementation of a hybrid DFT method for calculating NMR shieldings using Slater-type orbitals with spin-orbital coupling included. Applications to 187Os, 195Pt, and 13C in heavy-metal complexesMykhaylo Krykunov, Tom Ziegler, Erik van Lenthe
Journal of the American Chemical Society|January 23, 2003
Theoretical investigation of the apparently irregular behavior of pt-pt nuclear spin-spin coupling constantsJochen Autschbach, Ciprian D Igna, Tom Ziegler
The Journal of Physical Chemistry. A|July 17, 2008
Bond multiplicity in transition-metal complexes: applications of two-electron valence indicesArtur Michalak, Roger L DeKock, Tom Ziegler
Pageof 11

Showing results (51-60 of 108) with videos related to

Sort By:
Pageof 11
Journal of the American Chemical Society|April 17, 2003
A theoretical study of the large Hg-Hg spin-spin coupling constants in Hg(2)(2+), Hg(3)(2+), and Hg(2)(2+)-crown ether complexesJochen Autschbach, Ciprian D Igna, Tom Ziegler
The Journal of Physical Chemistry. A|July 13, 2006
The influence of solvation and finite temperatures on theWittig reaction: A theoretical studyMichael Seth, Hans Martin Senn, Tom Ziegler
The Journal of Chemical Physics|November 18, 2011
Calculation of the exchange coupling constants of copper binuclear systems based on spin-flip constricted variational density functional theoryHristina R Zhekova, Michael Seth, Tom Ziegler
Journal of the American Chemical Society|January 20, 2005
On the origin of optical activity in tris-diamine complexes of Co(III) and Rh(III): a simple model based on time-dependent density function theoryFrancisco Elias Jorge, Jochen Autschbach, Tom Ziegler
Inorganic Chemistry|February 25, 2009
A theoretical study of the magnetic circular dichroism spectrum for sulfite oxidase based on time-dependent density functional theoryElizabeth Hernandez-Marin, Michael Seth, Tom Ziegler
Inorganic Chemistry|January 23, 2010
Density functional theory study of the electron paramagnetic resonance parameters and the magnetic circular dichroism spectrum for model compounds of dimethyl sulfoxide reductaseElizabeth Hernandez-Marin, Michael Seth, Tom Ziegler
Inorganic Chemistry|June 4, 2010
Density functional theory study of the magnetic circular dichroism spectra of molybdenyl complexesElizabeth Hernandez-Marin, Michael Seth, Tom Ziegler
The Journal of Physical Chemistry. A|September 8, 2009
Implementation of a hybrid DFT method for calculating NMR shieldings using Slater-type orbitals with spin-orbital coupling included. Applications to 187Os, 195Pt, and 13C in heavy-metal complexesMykhaylo Krykunov, Tom Ziegler, Erik van Lenthe
Journal of the American Chemical Society|January 23, 2003
Theoretical investigation of the apparently irregular behavior of pt-pt nuclear spin-spin coupling constantsJochen Autschbach, Ciprian D Igna, Tom Ziegler
The Journal of Physical Chemistry. A|July 17, 2008
Bond multiplicity in transition-metal complexes: applications of two-electron valence indicesArtur Michalak, Roger L DeKock, Tom Ziegler
Pageof 11