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Inorganic Chemistry

Working Paper

Theoretical Investigation of Transient Species following Photodissociation of Ironpentacarbonyl in Ethanol Solution

Michael R. Coates, Ambar Banerjee, Raphael M. Jay, Philippe Wernet, Michael Odelius

Version 1 posted 19 March 2024

78

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1

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Organometallic Chemistry

Working Paper

Photochemical Formation and Electronic Structure of an Alkane 𝜎-Complex from Time-Resolved Optical and X-ray Absorption Spectroscopy

Raphael Jay, Michael R. Coates, Huan Zhao, Marc-Oliver Winghart, Peng Han, Ru-Pan Wang, Jessica Harich, Ambar Banerjee, Hampus Wikmark, Mattis Fondell, Erik T. J. Nibbering, Michael Odelius, Nils Huse, Philippe Wernet

Version 1 posted 09 February 2024

294

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Theoretical and Computational Chemistry

Working Paper

Performance of Electronic Structure Methods for the Description of Hückel-Möbius Interconversions in Extended π-Systems

Tatiana Woller, Ambar Banerjee, Nitai Sylvetsky, Xavier Deraet, Frank De Proft, Gershom Martin, Mercedes Alonso

Version 1 posted 28 November 2019

529

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Theoretical and Computational Chemistry

Working Paper

A Theoretical Approach to Demystify the Role of Copper Salts and O2 in the Mechanism of C-N Bond Cleavage and Nitrogen Transfer

Boyli Ghosh, Ambar Banerjee, Lisa Roy, Rounak Nath, Rabindra Nath Manna Manna, Ankan Paul

Version 1 posted 03 May 2021

326

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Organometallic Chemistry

Working Paper

Tracking C-H activation with orbital resolution

Raphael Jay, Ambar Banerjee, Torsten Leitner, Ru-Pan Wang, Jessica Harich, Robert Stefanuik, Hampus Wikmark, Michael Coates, Emma Beale, Victoria Kabanova, Abdullah Kahraman, Anna Wach, Dmitry Ozerov, Christopher Arrell, Philip Johnson, Camelia Borca, Claudio Cirelli, Camila Bacellar, Christopher Milne, Nils Huse, Grigory Smolentsev, Thomas Huthwelker, Michael Odelius, Philippe Wernet

Version 1 posted 17 January 2023

532

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1

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Theoretical and Computational Chemistry

Working Paper

Serendipitous Triplet Harvesting in Donor-acceptor Dyads with Low Spin-orbit Coupling

Pijush Karak, Torsha Moitra, Ambar Banerjee, Kenneth Ruud, Swapan Chakrabarti

Version 2 posted 19 June 2023

371

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Inorganic Chemistry

Working Paper

Hydration dynamics gives the distinctive brown color in the "brown ring" nitrate test

Ambar Banerjee, Michael R. Coates, Michael Odelius

Version 2 posted 05 October 2021

1,198

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Theoretical and Computational Chemistry

Working Paper

Photoinduced bond oscillations in ironpentacarbonylFe(CO)5 give delayed, synchronous bursts of carbonmonoxide(CO) release

Ambar Banerjee, Michael R. Coates, Markus Kowalewski, Hampus Wikmark, Raphael M. Jay, Philippe Wernet, Michael Odelius

Version 2 posted 12 July 2021

418

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Physical Chemistry

Working Paper

Simulating fluorine K-edge resonant inelastic X-ray scattering of sulfur hexafluoride and the effect of dissociative dynamics

Ambar Banerjee, Vinícius Vaz da Cruz, Victor Ekholm, Conny Såthe, Jan-Erik Rubensson, Nina Ignatova, Faris Gel’mukhanov, Michael Odelius

Version 1 posted 21 April 2023

214

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Physical Chemistry

Working Paper

Different photo-dissociation mechanisms in Fe(CO)5 and Cr(CO)6 evidenced with femtosecond valence photoelectron spectroscopy and excited-state molecular dynamics simulations

Henning Schröder, Michael Coates, Raphael Jay, Ambar Banerjee, Nomi Sorgenfrei, Christian Weniger, Rolf Mitzner, Alexander Föhlisch, Michael Odelius, Philippe Wernet

Version 1 posted 12 July 2024

122

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1

Citations

Refine Search

12 results in Ambar Banerjee in Authors: Ambar Banerjee

Theoretical Investigation of Transient Species following Photodissociation of Ironpentacarbonyl in Ethanol Solution

Photochemical Formation and Electronic Structure of an Alkane 𝜎-Complex from Time-Resolved Optical and X-ray Absorption Spectroscopy

Performance of Electronic Structure Methods for the Description of Hückel-Möbius Interconversions in Extended π-Systems

A Theoretical Approach to Demystify the Role of Copper Salts and O2 in the Mechanism of C-N Bond Cleavage and Nitrogen Transfer

Tracking C-H activation with orbital resolution

Serendipitous Triplet Harvesting in Donor-acceptor Dyads with Low Spin-orbit Coupling

Hydration dynamics gives the distinctive brown color in the "brown ring" nitrate test

Photoinduced bond oscillations in ironpentacarbonylFe(CO)5 give delayed, synchronous bursts of carbonmonoxide(CO) release

Simulating fluorine K-edge resonant inelastic X-ray scattering of sulfur hexafluoride and the effect of dissociative dynamics

Different photo-dissociation mechanisms in Fe(CO)5 and Cr(CO)6 evidenced with femtosecond valence photoelectron spectroscopy and excited-state molecular dynamics simulations

12 results in Authors: Ambar Banerjee