Covalency-Driven Preservation of Local Charge Densities in a Metal-to-Ligand Charge-Transfer Excited Iron Photosensitizer

Electronic structure in the transition metal block and its implications for light harvesting

(2019) James K. McCusker   SCIENCE

Elucidating the Nature of the Excited State of a Heteroleptic Copper Photosensitizer by using Time-Resolved X-ray Absorption Spectroscopy

(2018) Dooshaye Moonshiram et al.   CHEMISTRY-A EUROPEAN JOURNAL

Disentangling Transient Charge Density and Metal–Ligand Covalency in Photoexcited Ferricyanide with Femtosecond Resonant Inelastic Soft X-ray Scattering

(2018) Raphael M. Jay et al.   Journal of Physical Chemistry Letters

Solvent control of charge transfer excited state relaxation pathways in [Fe(2,2′-bipyridine)(CN)4]2−

(2018) Kasper S. Kjær et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Probing the Oxidation State of Transition Metal Complexes: A Case Study on How Charge and Spin Densities Determine Mn L-Edge X-ray Absorption Energies

(2018) Markus Kubin et al.   Chemical Science

The nature of frontier orbitals under systematic ligand exchange in (pseudo-)octahedral Fe(ii) complexes

(2018) Raphael M. Jay et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Interfacial Electron Injection Probed by a Substrate-Specific Excitonic Signature

(2017) Edoardo Baldini et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Manipulating charge transfer excited state relaxation and spin crossover in iron coordination complexes with ligand substitution

(2017) Wenkai Zhang et al.   Chemical Science

Ligand manipulation of charge transfer excited state relaxation and spin crossover in [Fe(2,2′-bipyridine)2(CN)2]

(2017) Kasper S. Kjær et al.   Structural Dynamics

Fe N-Heterocyclic Carbene Complexes as Promising Photosensitizers

(2016) Yizhu Liu et al.   ACCOUNTS OF CHEMICAL RESEARCH

Viewing the Valence Electronic Structure of Ferric and Ferrous Hexacyanide in Solution from the Fe and Cyanide Perspectives

(2016) Kristjan Kunnus et al.   JOURNAL OF PHYSICAL CHEMISTRY B

Sub-50-fs photoinduced spin crossover in [Fe(bpy)3]2+

(2015) Gerald Auböck et al.   Nature Chemistry

Iron sensitizer converts light to electrons with 92% yield

(2015) Tobias C. B. Harlang et al.   Nature Chemistry

Restricted active space calculations of L-edge X-ray absorption spectra: From molecular orbitals to multiplet states

(2014) Rahul V. Pinjari et al.   JOURNAL OF CHEMICAL PHYSICS

Exceptional Excited-State Lifetime of an Iron(II)–N-Heterocyclic Carbene Complex Explained

(2014) Lisa A. Fredin et al.   Journal of Physical Chemistry Letters

Atomic-Scale Perspective of Ultrafast Charge Transfer at a Dye–Semiconductor Interface

(2014) Katrin R. Siefermann et al.   Journal of Physical Chemistry Letters

Kβ Mainline X-ray Emission Spectroscopy as an Experimental Probe of Metal–Ligand Covalency

(2014) Christopher J. Pollock et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Tracking excited-state charge and spin dynamics in iron coordination complexes

(2014) Wenkai Zhang et al.   NATURE

A combined DFT and restricted open-shell configuration interaction method including spin-orbit coupling: Application to transition metal L-edge X-ray absorption spectroscopy

(2013) Michael Roemelt et al.   JOURNAL OF CHEMICAL PHYSICS

Probing the Electronic Structure of a Photoexcited Solar Cell Dye with Transient X-ray Absorption Spectroscopy

(2012) Benjamin E. Van Kuiken et al.   Journal of Physical Chemistry Letters

Photo-Induced Spin-State Conversion in Solvated Transition Metal Complexes Probed via Time-Resolved Soft X-ray Spectroscopy

(2010) Nils Huse et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY