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The Journal of Chemical Physics|November 17, 2015
Communication: X-ray absorption spectra and core-ionization potentials within a core-valence separated coupled cluster frameworkSonia Coriani, Henrik Koch
Journal of Chemical Theory and Computation|May 17, 2016
Near-Edge X-ray Absorption Fine Structure within Multilevel Coupled Cluster TheoryRolf H Myhre, Sonia Coriani, Henrik Koch
The Journal of Physical Chemistry. A|September 25, 2019
X-ray and UV Spectra of Glycine within Coupled Cluster Linear Response TheoryRolf H Myhre, Sonia Coriani, Henrik Koch
The Journal of Chemical Physics|October 17, 2019
Spin adapted implementation of EOM-CCSD for triplet excited states: Probing intersystem crossings of acetylacetone at the carbon and oxygen K-edgesRasmus Faber, Eirik F Kjønstad, Henrik Koch, et al.
The Journal of Physical Chemistry Letters|June 6, 2020
Accurate Description of Photoionization Dynamical ParametersTorsha Moitra, Aurora Ponzi, Henrik Koch, et al.
Physical Chemistry Chemical Physics : PCCP|March 24, 2022
Multi-electron excitation contributions towards primary and satellite states in the photoelectron spectrumTorsha Moitra, Alexander C Paul, Piero Decleva, et al.
The Journal of Chemical Physics|July 1, 2022
Efficient implementation of molecular CCSD gradients with Cholesky-decomposed electron repulsion integralsAnna Kristina Schnack-Petersen, Henrik Koch, Sonia Coriani, et al.
Physical Chemistry Chemical Physics : PCCP|February 10, 2022
Excited state absorption of DNA bases in the gas phase and in chloroform solution: a comparative quantum mechanical studyDaniil A Fedotov, Alexander C Paul, Henrik Koch, et al.
The Journal of Chemical Physics|February 17, 2018
A theoretical and experimental benchmark study of core-excited states in nitrogenRolf H Myhre, Thomas J A Wolf, Lan Cheng, et al.
Journal of Chemical Theory and Computation|February 2, 2021
Excited-State Absorption of Uracil in the Gas Phase: Mapping the Main Decay Paths by Different Electronic Structure MethodsDaniil A Fedotov, Alexander C Paul, Paolo Posocco, et al.
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