Marcus Lundberg (M Lundberg)

Publication Activity (10 Years)

Years Active: 2018-2023
Publications (10 Years): 18

Top Topics

Transition Metal

Electron Transfer

Molecular Dynamics Simulations

Top Venues

Journal of chemical theory and computation

Physical chemistry chemical physics : PCCP

Inorganic chemistry

Chemical science

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

Publications

Olesya S Ablyasova, Meiyuan Guo, Vicente Zamudio-Bayer, Markus Kubin, Tim Gitzinger, Mayara da Silva Santos, Max Flach, Martin Timm, Marcus Lundberg, J Tobias Lau, Konstantin Hirsch
Electronic Structure of the Complete Series of Gas-Phase Manganese Acetylacetonates by X-ray Absorption Spectroscopy. The journal of physical chemistry. A (2023)
Giovanni Li Manni, Ignacio Fdez Galván, Ali Alavi, Flavia Aleotti, Francesco Aquilante, Jochen Autschbach, Davide Avagliano, Alberto Baiardi, Jie J Bao, Stefano Battaglia, Letitia Birnoschi, Alejandro Blanco-González, Sergey I Bokarev, Ria Broer, Roberto Cacciari, Paul B Calio, Rebecca K Carlson, Rafael C Couto, Luis Cerdán, Liviu F Chibotaru, Nicholas F Chilton, Jonathan Richard Church, Irene Conti, Sonia Coriani, Juliana Cuéllar-Zuquin, Razan E Daoud, Nike Dattani, Piero Decleva, Coen de Graaf, Mickaël G Delcey, Luca De Vico, Werner Dobrautz, Sijia S Dong, Rulin Feng, Nicolas Ferré, Michael Filatov Gulak, Soumen Ghosh, Marco Garavelli, Leticia González, Yafu Guan, Meiyuan Guo, Matthew R Hennefarth, Matthew R Hermes, Chad E Hoyer, Miquel Huix-Rotllant, Vishal Kumar Jaiswal, Andy Kaiser, Danil S Kaliakin, Marjan Khamesian, Daniel S King, Vladislav Kochetov, Marek Krośnicki, Arpit Arun Kumaar, Ernst Dennis Larsson, Susi Lehtola, Marie-Bernadette Lepetit, Hans Lischka, Pablo López Ríos, Marcus Lundberg, Dongxia Ma, Sebastian Mai, Philipp Marquetand, Isabella C D Merritt, Francesco Montorsi, Maximilian Mörchen, Artur Nenov, Vu Ha Anh Nguyen, Yoshio Nishimoto, Meagan S Oakley, Massimo Olivucci, Markus Oppel, Daniele Padula, Riddhish Pandharkar, Quan Manh Phung, Felix Plasser, Gerardo Raggi, Elisa Rebolini, Markus Reiher, Ivan Rivalta, Daniel Roca-Sanjuán, Thies Romig, Arta Anushirwan Safari, Aitor Sánchez-Mansilla, Andrew M Sand, Igor Schapiro, Thais R Scott, Javier Segarra-Marti, Francesco Segatta, Dumitru-Claudiu Sergentu, Prachi Sharma, Ron Shepard, Yinan Shu, Jakob K Staab, Tjerk P Straatsma, Lasse Kragh Sørensen, Bruno Nunes Cabral Tenorio, Donald G Truhlar, Liviu Ungur, Morgane Vacher, Valera Veryazov, Torben Arne Voß, Oskar Weser, Dihua Wu, Xuchun Yang, David R Yarkony, Chen Zhou, J Patrick Zobel, Roland Lindh
The OpenMolcas Web : A Community-Driven Approach to Advancing Computational Chemistry. Journal of chemical theory and computation (2023)
Johanna Rogvall, Roshan Singh, Morgane Vacher, Marcus Lundberg
Sensitivity of Kβ mainline X-ray emission to structural dynamics in iron photosensitizer. Physical chemistry chemical physics : PCCP (2023)
Mickaël G Delcey, Rebecka Lindblad, Martin Timm, Christine Bülow, Vicente Zamudio-Bayer, Bernd von Issendorff, J Tobias Lau, Marcus Lundberg
Soft X-ray signatures of cationic manganese-oxo systems, including a high-spin manganese(V) complex. Physical chemistry chemical physics : PCCP 24 (6) (2022)
Manuel Boniolo, Md Kamal Hossain, Petko Chernev, Nina F Suremann, Philipp A Heizmann, Amanda S L Lyvik, Paul Beyer, Michael Haumann, Ping Huang, Nessima Salhi, Mun Hon Cheah, Sergii I Shylin, Marcus Lundberg, Anders Thapper, Johannes Messinger
Water Oxidation by Pentapyridyl Base Metal Complexes? A Case Study. Inorganic chemistry 61 (24) (2022)
Thomas Kroll, Michael L Baker, Samuel A Wilson, Marcus Lundberg, Amélie Juhin, Marie-Anne Arrio, James J Yan, Leland B Gee, Augustin Braun, Tsu-Chien Weng, Dimosthenis Sokaras, Britt Hedman, Keith O Hodgson, Edward I Solomon
Effect of 3d/4p Mixing on 1s2p Resonant Inelastic X-ray Scattering: Electronic Structure of Oxo-Bridged Iron Dimers. Journal of the American Chemical Society 143 (12) (2021)
Morgane Vacher, Kristjan Kunnus, Mickaël G Delcey, Kelly J Gaffney, Marcus Lundberg
Origin of core-to-core x-ray emission spectroscopy sensitivity to structural dynamics. Structural dynamics (Melville, N.Y.) 7 (4) (2020)
Kristjan Kunnus, Morgane Vacher, Tobias C B Harlang, Kasper S Kjær, Kristoffer Haldrup, Elisa Biasin, Tim B van Driel, Mátyás Pápai, Pavel Chàbera, Yizhu Liu, Hideyuki Tatsuno, Cornelia Timm, Erik Källman, Mickaël Delcey, Robert W Hartsock, Marco E Reinhard, Sergey Koroidov, Mads G Laursen, Frederik B Hansen, Peter Vester, Morten Christensen, Lise Sandberg, Zoltán Németh, Dorottya Sárosiné Szemes, Éva G Bajnóczi, Roberto Alonso Mori, James M Glownia, Silke Nelson, Marcin Sikorski, Dimosthenis Sokaras, Henrik Till Lemke, Sophie E Canton, Klaus Braagaard Mo Ller, Martin Meedom Nielsen, György Vankó, Kenneth Wärnmark, Villy Sundström, Petter Persson, Marcus Lundberg, Jens Uhlig, Kelly J Gaffney
Vibrational wavepacket dynamics in Fe carbene photosensitizer determined with femtosecond X-ray emission and scattering. Nature communications 11 (1) (2020)
Mickaël G Delcey, Lasse Kragh Sørensen, Morgane Vacher, Rafael C Couto, Marcus Lundberg
Efficient calculations of a large number of highly excited states for multiconfigurational wavefunctions. Journal of computational chemistry 40 (19) (2019)
Yves Kayser, Christopher J Milne, Pavle Juranić, Leonardo Sala, Joanna Czapla-Masztafiak, Rolf Follath, Matjaž Kavčič, Gregor Knopp, Jens Rehanek, Wojciech Błachucki, Mickaël G Delcey, Marcus Lundberg, Krzysztof Tyrala, Diling Zhu, Roberto Alonso Mori, Rafael Abela, Jacinto Sá, Jakub Szlachetko
Core-level nonlinear spectroscopy triggered by stochastic X-ray pulses. Nature communications 10 (1) (2019)
Ignacio Fdez Galván, Morgane Vacher, Ali Alavi, Celestino Angeli, Francesco Aquilante, Jochen Autschbach, Jie J Bao, Sergey I Bokarev, Nikolay A Bogdanov, Rebecca K Carlson, Liviu F Chibotaru, Joel Creutzberg, Nike Dattani, Mickaël G Delcey, Sijia S Dong, Andreas Dreuw, Leon Freitag, Luis Manuel Frutos, Soumen Ghosh, Frédéric Gendron, Angelo Giussani, Leticia González, Gilbert Grell, Meiyuan Guo, Chad E Hoyer, Marcus Johansson, Sebastian Keller, Stefan Knecht, Goran Kovačević, Erik Källman, Giovanni Li Manni, Marcus Lundberg, Yingjin Ma, Sebastian Mai, João Pedro Malhado, Per Åke Malmqvist, Philipp Marquetand, Stefanie A Mewes, Jesper Norell, Massimo Olivucci, Markus Oppel, Quan Manh Phung, Kristine Pierloot, Felix Plasser, Markus Reiher, Andrew M Sand, Igor Schapiro, Prachi Sharma, Christopher J Stein, Lasse Kragh Sørensen, Donald G Truhlar, Mihkel Ugandi, Liviu Ungur, Alessio Valentini, Steven Vancoillie, Valera Veryazov, Oskar Weser, Tomasz Adam Wesołowski, Per-Olof Widmark, Sebastian Wouters, Alexander Zech, J Patrick Zobel, Roland Lindh
OpenMolcas: From Source Code to Insight. Journal of chemical theory and computation 15 (11) (2019)
Wojciech Błachucki, Y Kayser, J Czapla-Masztafiak, M Guo, P Juranić, M Kavčič, E Källman, G Knopp, Marcus Lundberg, Christopher J Milne, Jens Rehanek, Jacinto Sá, Jakub Szlachetko
Inception of electronic damage of matter by photon-driven post-ionization mechanisms. Structural dynamics (Melville, N.Y.) 6 (2) (2019)
Markus Kubin, Meiyuan Guo, Maria Ekimova, Michael L Baker, Thomas Kroll, Erik Källman, Jan Kern, Vittal K Yachandra, Junko Yano, Erik T J Nibbering, Marcus Lundberg, Philippe Wernet
Direct Determination of Absolute Absorption Cross Sections at the L-Edge of Dilute Mn Complexes in Solution Using a Transmission Flatjet. Inorganic chemistry 57 (9) (2018)
Belinda Pettersson Rimgard, Jens Föhlinger, Jonas Petersson, Marcus Lundberg, Burkhard Zietz, Ann Marie Woys, Stephen A Miller, Michael R Wasielewski, Leif Hammarström
Ultrafast interligand electron transfer in cis-[Ru(4,4'-dicarboxylate-2,2'-bipyridine)2(NCS)2]4- and implications for electron injection limitations in dye sensitized solar cells. Chemical science 9 (41) (2018)
Meiyuan Guo, Erik Källman, Rahul V Pinjari, Rafael C Couto, Lasse Kragh Sørensen, Roland Lindh, Kristine Pierloot, Marcus Lundberg
Fingerprinting Electronic Structure of Heme Iron by Ab Initio Modeling of Metal L-Edge X-ray Absorption Spectra. Journal of chemical theory and computation 15 (1) (2018)
Markus Kubin, Meiyuan Guo, Maria Ekimova, Erik Källman, Jan Kern, Vittal K Yachandra, Junko Yano, Erik T J Nibbering, Marcus Lundberg, Philippe Wernet
Cr L-Edge X-ray Absorption Spectroscopy of CrIII(acac)3 in Solution with Measured and Calculated Absolute Absorption Cross Sections. The journal of physical chemistry. B 122 (29) (2018)
Raphael M Jay, Jesper Norell, Sebastian Eckert, Markus Hantschmann, Martin Beye, Brian Kennedy, Wilson Quevedo, William F Schlotter, Georgi L Dakovski, Michael P Minitti, Matthias C Hoffmann, Ankush Mitra, Stefan P Moeller, Dennis Nordlund, Wenkai Zhang, Huiyang W Liang, Kristjan Kunnus, Katharina Kubiček, Simone A Techert, Marcus Lundberg, Philippe Wernet, Kelly Gaffney, Michael Odelius, Alexander Föhlisch
Disentangling Transient Charge Density and Metal-Ligand Covalency in Photoexcited Ferricyanide with Femtosecond Resonant Inelastic Soft X-ray Scattering. The journal of physical chemistry letters 9 (12) (2018)
Markus Kubin, Meiyuan Guo, Thomas Kroll, Heike Löchel, Erik Källman, Michael L Baker, Rolf Mitzner, Sheraz Gul, Jan F Kern, Alexander Föhlisch, Alexei Erko, Uwe Bergmann, Vittal Yachandra, Junko Yano, Marcus Lundberg, Philippe Wernet
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. Chemical science 9 (33) (2018)