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The Journal of Chemical Physics
|
February 1, 2016
Communication: A simplified coupled-cluster Lagrangian for polarizable embedding
Katharina Krause, Wim Klopper
The Journal of Chemical Physics
|
March 16, 2015
Description of spin-orbit coupling in excited states with two-component methods based on approximate coupled-cluster theory
Katharina Krause, Wim Klopper
Journal of Computational Chemistry
|
December 8, 2016
Implementation of the Bethe-Salpeter equation in the TURBOMOLE program
Katharina Krause, Wim Klopper
The Journal of Chemical Physics
|
December 11, 2013
Communication: two-component ring-coupled-cluster computation of the correlation energy in the random-phase approximation
Katharina Krause, Wim Klopper
Journal of Computational Chemistry
|
January 18, 2014
Conductor-like screening model for relaxed excited states: Implementation in the semiempirical method MSINDO
Katharina Krause, Thomas Bredow
Journal of Chemical Theory and Computation
|
May 10, 2016
Approaching Phosphorescence Lifetimes in Solution: The Two-Component Polarizable-Embedding Approximate Coupled-Cluster Method
Katharina Krause, Mirko Bauer, Wim Klopper
Journal of Neurological Surgery. Part A, Central European Neurosurgery
|
March 30, 2026
Microsurgical Resection of a Cavernous malformation of the trochlear nerve - a case-report
Katharina Krause, Peter Vajkoczy, Anton Früh
Journal of Computational Chemistry
|
February 20, 2015
Solvatochromic shifts of Br₂ and I₂ in water cages of type 5¹², 5¹²6², 5¹²6³, and 5¹²6⁴
Nils Middendorf, Katharina Krause, Sebastian Höfener
Journal of Chemical Theory and Computation
|
November 24, 2015
Analytical Gradients for the MSINDO-sCIS and MSINDO-UCIS Method: Theory, Implementation, Benchmarks, and Examples
Immanuel Gadaczek, Katharina Krause, Kim Julia Hintze, et al.
Journal of Chemical Theory and Computation
|
November 25, 2015
MSINDO-sCIS: A New Method for the Calculation of Excited States of Large Molecules
Immanuel Gadaczek, Katharina Krause, Kim Julia Hintze, et al.
Page
of 2
Search research articles
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Showing results (1-10 of 19) with videos related to
Sort By:
Page
of 2
The Journal of Chemical Physics
|
February 1, 2016
Communication: A simplified coupled-cluster Lagrangian for polarizable embedding
Katharina Krause, Wim Klopper
The Journal of Chemical Physics
|
March 16, 2015
Description of spin-orbit coupling in excited states with two-component methods based on approximate coupled-cluster theory
Katharina Krause, Wim Klopper
Journal of Computational Chemistry
|
December 8, 2016
Implementation of the Bethe-Salpeter equation in the TURBOMOLE program
Katharina Krause, Wim Klopper
The Journal of Chemical Physics
|
December 11, 2013
Communication: two-component ring-coupled-cluster computation of the correlation energy in the random-phase approximation
Katharina Krause, Wim Klopper
Journal of Computational Chemistry
|
January 18, 2014
Conductor-like screening model for relaxed excited states: Implementation in the semiempirical method MSINDO
Katharina Krause, Thomas Bredow
Journal of Chemical Theory and Computation
|
May 10, 2016
Approaching Phosphorescence Lifetimes in Solution: The Two-Component Polarizable-Embedding Approximate Coupled-Cluster Method
Katharina Krause, Mirko Bauer, Wim Klopper
Journal of Neurological Surgery. Part A, Central European Neurosurgery
|
March 30, 2026
Microsurgical Resection of a Cavernous malformation of the trochlear nerve - a case-report
Katharina Krause, Peter Vajkoczy, Anton Früh
Journal of Computational Chemistry
|
February 20, 2015
Solvatochromic shifts of Br₂ and I₂ in water cages of type 5¹², 5¹²6², 5¹²6³, and 5¹²6⁴
Nils Middendorf, Katharina Krause, Sebastian Höfener
Journal of Chemical Theory and Computation
|
November 24, 2015
Analytical Gradients for the MSINDO-sCIS and MSINDO-UCIS Method: Theory, Implementation, Benchmarks, and Examples
Immanuel Gadaczek, Katharina Krause, Kim Julia Hintze, et al.
Journal of Chemical Theory and Computation
|
November 25, 2015
MSINDO-sCIS: A New Method for the Calculation of Excited States of Large Molecules
Immanuel Gadaczek, Katharina Krause, Kim Julia Hintze, et al.
Page
of 2