Christel M Marian (Christel Marian)

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 38

Top Topics

Density Functional Theory

Room Temperature

Energy Transfer

Top Venues

Inorganic chemistry

The journal of physical chemistry. A

The journal of physical chemistry letters

The Journal of chemical physics

This page only lists publications with an associated author ORCID identifier.

Publications

Timo Schulz, Christel M Marian
Simulating the full spin manifold of triplet-pair states in a series of covalently linked TIPS-pentacenes. Journal of computational chemistry (2024)
Julia Kuhnt, Mousree Mitra, Sabyasachi Maity, Benjamin Hupp, Christel M Marian, Andreas Steffen
Enhanced Intersystem Crossing, Yet Still Fluorescence Upon Introduction of Intermediate Charge-Transfer States in Hemicaged [Zn(bpy) 3 ] 2 . The journal of physical chemistry letters 15 (24) (2024)
Julia Kuhnt, Mousree Mitra, Sabyasachi Maity, Benjamin Hupp, Christel M Marian, Andreas Steffen
Enhanced Intersystem Crossing, Yet Still Fluorescence Upon Introduction of Intermediate Charge-Transfer States in Hemicaged [Zn(bpy) 3 ] 2 . The journal of physical chemistry letters (2024)
Timo Schulz, Paul Konieczny, Dennis R Dombrowski, Simon Metz, Christel M Marian, Rainer Weinkauf
Electron affinities and lowest triplet and singlet state properties of para -oligophenylenes ( n = 3-5): theory and experiment. Physical chemistry chemical physics : PCCP (2023)
Dennis R Dombrowski, Timo Schulz, Martin Kleinschmidt, Christel M Marian
R2022: A DFT/MRCI Ansatz with Improved Performance for Double Excitations. The journal of physical chemistry. A 127 (8) (2023)
Stefan Koop, Ondřej Mrózek, Lars Janiak, Andrey Belyaev, Markus Putscher, Christel M Marian, Andreas Steffen
Synthesis, Structural Characterization, and Phosphorescence Properties of Trigonal Zn(II) Carbene Complexes. Inorganic chemistry 63 (1) (2023)
Hector Miranda-Salinas, Angela Rodriguez-Serrano, Jeremy M Kaminski, Fabian Dinkelbach, Nakagawa Hiromichi, Yu Kusakabe, Hironori Kaji, Christel M Marian, Andrew P Monkman
Conformational, Host, and Vibrational Effects Giving Rise to Dynamic TADF Behavior in the Through-Space Charge Transfer, Triptycene Bridged Acridine-Triazine Donor Acceptor TADF Molecule TpAT-tFFO . The journal of physical chemistry. C, Nanomaterials and interfaces 127 (18) (2023)
Markus Putscher, Christel M Marian
Polarity-Tunable Luminescence and Intersystem Crossing of a Zinc(II) Diimine Dithiolate Complex. The journal of physical chemistry. A (2023)
Hector Miranda-Salinas, Angela Rodriguez-Serrano, Jeremy M Kaminski, Fabian Dinkelbach, Nakagawa Hiromichi, Yu Kusakabe, Hironori Kaji, Christel M Marian, Andrew P Monkman
Conformational, Host, and Vibrational Effects Giving Rise to Dynamic TADF Behavior in the Through-Space Charge Transfer, Triptycene Bridged Acridine-Triazine Donor Acceptor TADF Molecule TpAT-tFFO . The journal of physical chemistry. C, Nanomaterials and interfaces 127 (18) (2023)
Dennis R Dombrowski, Timo Schulz, Martin Kleinschmidt, Christel M Marian
R2022: A DFT/MRCI Ansatz with Improved Performance for Double Excitations. The journal of physical chemistry. A (2023)
Stefan Koop, Ondřej Mrózek, Lars Janiak, Andrey Belyaev, Markus Putscher, Christel M Marian, Andreas Steffen
Synthesis, Structural Characterization, and Phosphorescence Properties of Trigonal Zn(II) Carbene Complexes. Inorganic chemistry (2023)
Zhu Wu, Fabian Dinkelbach, Florian Kerner, Alexandra Friedrich, Lei Ji, Vladimir Stepanenko, Frank Würthner, Christel M Marian, Todd B Marder
Aggregation-Induced Dual Phosphorescence from (o-Bromophenyl)-Bis(2,6-Dimethylphenyl)Borane at Room Temperature. Chemistry (Weinheim an der Bergstrasse, Germany) 28 (30) (2022)
Nora Lüdtke, Andreas Steffen, Christel M Marian
Finding Design Principles of OLED Emitters through Theoretical Investigations of Zn(II) Carbene Complexes. Inorganic chemistry 61 (51) (2022)
Jeremy M Kaminski, Angela Rodríguez-Serrano, Fabian Dinkelbach, Hector Miranda-Salinas, Andrew P Monkman, Christel M Marian
Vibronic effects accelerate the intersystem crossing processes of the through-space charge transfer states in the triptycene bridged acridine-triazine donor-acceptor molecule TpAT-tFFO. Chemical science 13 (23) (2022)
Ondřej Mrózek, Markus Gernert, Andrey Belyaev, Mousree Mitra, Lars Janiak, Christel M Marian, Andreas Steffen
Ultra-Long Lived Luminescent Triplet Excited States in Cyclic (Alkyl)(amino)carbene Complexes of Zn(II) Halides. Chemistry (Weinheim an der Bergstrasse, Germany) 28 (45) (2022)
Nora Lüdtke, Andreas Steffen, Christel M Marian
Finding Design Principles of OLED Emitters through Theoretical Investigations of Zn(II) Carbene Complexes. Inorganic chemistry (2022)
Kristoffer A Thom, Felix Wieser, Kevin Diestelhorst, Anna Reiffers, Constantin Czekelius, Martin Kleinschmidt, Mario Bracker, Christel M Marian, Peter Gilch
Acridones: Strongly Emissive HIGHrISC Fluorophores. The journal of physical chemistry letters 12 (24) (2021)
Torsten Hölzel, Andrey Belyaev, Meryem Terzi, Laura Stenzel, Markus Gernert, Christel M Marian, Andreas Steffen, Christian Ganter
Linear Carbene Pyridine Copper Complexes with Sterically Demanding N,N'-Bis(trityl)imidazolylidene: Syntheses, Molecular Structures, and Photophysical Properties. Inorganic chemistry 60 (23) (2021)
Mario Bracker, Christel M Marian, Martin Kleinschmidt
Internal conversion of singlet and triplet states employing numerical DFT/MRCI derivative couplings: Implementation, tests, and application to xanthone. The Journal of chemical physics 155 (1) (2021)
Jan Meissner, Bernd Kosper, Christel M Marian, Rainer Weinkauf
Lowest Triplet and Singlet States in N-Methylacridone and N,N'-Dimethylquinacridone: Theory and Experiment. The journal of physical chemistry. A 125 (40) (2021)
Fabian Dinkelbach, Mario Bracker, Martin Kleinschmidt, Christel M Marian
Large Inverted Singlet-Triplet Energy Gaps Are Not Always Favorable for Triplet Harvesting: Vibronic Coupling Drives the (Reverse) Intersystem Crossing in Heptazine Derivatives. The journal of physical chemistry. A 125 (46) (2021)
Nora Lüdtke, Jelena Föller, Christel M Marian
Understanding the luminescence properties of Cu(i) complexes: a quantum chemical perusal. Physical chemistry chemical physics : PCCP 22 (41) (2020)
Annika Liske, Lars Wallbaum, Torsten Hölzel, Jelena Föller, Markus Gernert, Benjamin Hupp, Christian Ganter, Christel M Marian, Andreas Steffen
Correction to "Cu-F Interactions between Cationic Linear N-Heterocyclic Carbene Copper(I) Pyridine Complexes and Their Counterions Greatly Enhance Blue Luminescence Efficiency". Inorganic chemistry 59 (7) (2020)
Markus Gernert, Lukas Balles-Wolf, Florian Kerner, Ulrich Müller, Alexander Schmiedel, Marco Holzapfel, Christel M Marian, Jens Pflaum, Christoph Lambert, Andreas Steffen
Cyclic (Amino)(aryl)carbenes Enter the Field of Chromophore Ligands: Expanded π System Leads to Unusually Deep Red Emitting CuI Compounds. Journal of the American Chemical Society 142 (19) (2020)
Mario Bracker, Lucas Helmecke, Martin Kleinschmidt, Constantin Czekelius, Christel M Marian
Visible Light-Induced Homolytic Cleavage of Perfluoroalkyl Iodides Mediated by Phosphines. Molecules (Basel, Switzerland) 25 (7) (2020)
Zhu Wu, Jörn Nitsch, Julia Schuster, Alexandra Friedrich, Katharina Edkins, Marcel Loebnitz, Fabian Dinkelbach, Vladimir Stepanenko, Frank Würthner, Christel M Marian, Lei Ji, Todd B Marder
Persistent Room Temperature Phosphorescence from Triarylboranes: A Combined Experimental and Theoretical Study. Angewandte Chemie (International ed. in English) 59 (39) (2020)
Annika Liske, Lars Wallbaum, Torsten Hölzel, Jelena Föller, Markus Gernert, Benjamin Hupp, Christian Ganter, Christel M Marian, Andreas Steffen
Cu-F Interactions between Cationic Linear N-Heterocyclic Carbene Copper(I) Pyridine Complexes and Their Counterions Greatly Enhance Blue Luminescence Efficiency. Inorganic chemistry 58 (9) (2019)
Jelena Föller, Christian Ganter, Andreas Steffen, Christel M Marian
Computer-Aided Design of Luminescent Linear N-Heterocyclic Carbene Copper(I) Pyridine Complexes. Inorganic chemistry 58 (9) (2019)
Issaka Seidu, Simon P Neville, Martin Kleinschmidt, Adrian Heil, Christel M Marian, Michael S Schuurman
The simulation of X-ray absorption spectra from ground and excited electronic states using core-valence separated DFT/MRCI. The Journal of chemical physics 151 (14) (2019)
Adrian Heil, Christel M Marian
Structure-Emission Property Relationships in Cyclometalated Pt(II) β-Diketonate Complexes. Inorganic chemistry 58 (9) (2019)
Daniel de Sa Pereira, Christopher Menelaou, Andrew Danos, Christel M Marian, Andrew P Monkman
Electroabsorption Spectroscopy as a Tool for Probing Charge Transfer and State Mixing in Thermally Activated Delayed Fluorescence Emitters. The journal of physical chemistry letters 10 (12) (2019)
Thomas J Penfold, Etienne Gindensperger, Chantal Daniel, Christel M Marian
Spin-Vibronic Mechanism for Intersystem Crossing. Chemical reviews 118 (15) (2018)
Adrian Heil, Martin Kleinschmidt, Christel M Marian
On the performance of DFT/MRCI Hamiltonians for electronic excitations in transition metal complexes: The role of the damping function. The Journal of chemical physics 149 (16) (2018)
Adrian Heil, Christel M Marian
DFT/MRCI Hamiltonian for odd and even numbers of electrons. The Journal of chemical physics 147 (19) (2018)
Igor Lyskov, Horst Köppel, Christel M Marian
Nonadiabatic photodynamics and UV absorption spectrum of all-trans-octatetraene. Physical chemistry chemical physics : PCCP 19 (5) (2018)
Fabian Dinkelbach, Martin Kleinschmidt, Christel M Marian
Assessment of Interstate Spin-Orbit Couplings from Linear Response Amplitudes. Journal of chemical theory and computation 13 (2) (2017)
Josefin Wilke, Martin Wilke, Christian Brand, J Dominik Spiegel, Christel M Marian, Michael Schmitt
Modulation of the La/Lb Mixing in an Indole Derivative: A Position-Dependent Study Using 4-, 5-, and 6-Fluoroindole. The journal of physical chemistry. A 121 (8) (2017)
Jelena Föller, Christel M Marian
Rotationally Assisted Spin-State Inversion in Carbene-Metal-Amides Is an Artifact. The journal of physical chemistry letters 8 (22) (2017)