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Angewandte Chemie (International Ed. in English)
|
January 27, 2004
Trigonal prismatic or not trigonal prismatic? On the mechanisms of oxygen-atom transfer in molybdopterin-based enzymes
Martin Kaupp
Journal of Computational Chemistry
|
December 5, 2006
The role of radial nodes of atomic orbitals for chemical bonding and the periodic table
Martin Kaupp
Biochemistry
|
February 28, 2002
The function of photosystem I. Quantum chemical insight into the role of tryptophan-quinone interactions
Martin Kaupp
Angewandte Chemie (International Ed. in English)
|
October 10, 2001
"Non-VSEPR" Structures and Bonding in d(0) Systems
Martin Kaupp
Journal of Chemical Theory and Computation
|
December 14, 2019
Noncollinear Relativistic Two-Component X2C Calculations of Hyperfine Couplings Using Local Hybrid Functionals. Importance of the High-Density Coordinate Scaling Limit
Artur Wodyński, Martin Kaupp
The Journal of Physical Chemistry. A
|
August 9, 2021
Reliable TDDFT Protocol Based on a Local Hybrid Functional for the Prediction of Vibronic Phosphorescence Spectra Applied to Tris(2,2'-bipyridine)-Metal Complexes
Robin Grotjahn, Martin Kaupp
The Journal of Physical Chemistry. B
|
April 14, 2006
Molecular mechanical devices based on quinone-pyrrole and quinone-indole dyads: a computational study
Sylwia Kacprzak, Martin Kaupp
Journal of Chemical Theory and Computation
|
December 28, 2022
Spin-State Splittings in 3d Transition-Metal Complexes Revisited: Toward a Reliable Theory Benchmark
Marc Reimann, Martin Kaupp
Journal of Chemical Theory and Computation
|
November 23, 2022
Spin-State Splittings in 3d Transition-Metal Complexes Revisited: Benchmarking Approximate Methods for Adiabatic Spin-State Energy Differences in Fe(II) Complexes
Marc Reimann, Martin Kaupp
Inorganic Chemistry
|
January 31, 2006
Has AuF7 been made?
Sebastian Riedel, Martin Kaupp
Page
of 26
Search research articles
Search
Showing results (1-10 of 255) with videos related to
Sort By:
Page
of 26
Angewandte Chemie (International Ed. in English)
|
January 27, 2004
Trigonal prismatic or not trigonal prismatic? On the mechanisms of oxygen-atom transfer in molybdopterin-based enzymes
Martin Kaupp
Journal of Computational Chemistry
|
December 5, 2006
The role of radial nodes of atomic orbitals for chemical bonding and the periodic table
Martin Kaupp
Biochemistry
|
February 28, 2002
The function of photosystem I. Quantum chemical insight into the role of tryptophan-quinone interactions
Martin Kaupp
Angewandte Chemie (International Ed. in English)
|
October 10, 2001
"Non-VSEPR" Structures and Bonding in d(0) Systems
Martin Kaupp
Journal of Chemical Theory and Computation
|
December 14, 2019
Noncollinear Relativistic Two-Component X2C Calculations of Hyperfine Couplings Using Local Hybrid Functionals. Importance of the High-Density Coordinate Scaling Limit
Artur Wodyński, Martin Kaupp
The Journal of Physical Chemistry. A
|
August 9, 2021
Reliable TDDFT Protocol Based on a Local Hybrid Functional for the Prediction of Vibronic Phosphorescence Spectra Applied to Tris(2,2'-bipyridine)-Metal Complexes
Robin Grotjahn, Martin Kaupp
The Journal of Physical Chemistry. B
|
April 14, 2006
Molecular mechanical devices based on quinone-pyrrole and quinone-indole dyads: a computational study
Sylwia Kacprzak, Martin Kaupp
Journal of Chemical Theory and Computation
|
December 28, 2022
Spin-State Splittings in 3d Transition-Metal Complexes Revisited: Toward a Reliable Theory Benchmark
Marc Reimann, Martin Kaupp
Journal of Chemical Theory and Computation
|
November 23, 2022
Spin-State Splittings in 3d Transition-Metal Complexes Revisited: Benchmarking Approximate Methods for Adiabatic Spin-State Energy Differences in Fe(II) Complexes
Marc Reimann, Martin Kaupp
Inorganic Chemistry
|
January 31, 2006
Has AuF7 been made?
Sebastian Riedel, Martin Kaupp
Page
of 26