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Catalysis

Working Paper

External Photosensitizer Free Function-Integrated Cu(II)-Complex Catalyzed Photo Driven CO2 Reduction

Soumadip Das, Aritra Roy, Navonil Chakrabarti, Narottam Mukhopadhyay, Aniruddha Sarkar, Sayam Sen Gupta

Version 1 posted 02 September 2024

221

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Inorganic Chemistry

Working Paper

Reactions of Aluminium(I) with Transition Metal Carbonyls: Scope, Mechanism and Selectivity of CO Homologation

Richard Kong, Maria Batuecas, Mark Crimmin

Version 1 posted 01 September 2021

717

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Theoretical and Computational Chemistry

Working Paper

The tmQM Dataset - Quantum Geometries and Properties of 86k Transition Metal Complexes

David Balcells, Bastian Bjerkem Skjelstad

Version 1 posted 31 August 2020

673

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Inorganic Chemistry

Working Paper

A Free Aluminylene with Diverse σ-Donating and Doubly σ/π-Accepting Ligand Features for Transition Metals

Xin Zhang, Liu Leo Liu

Version 2 posted 27 September 2021

835

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Catalysis

Working Paper

Oxidative CO2 dehydrogenation of butane on microspherical zeolite-containing composites based on kaolin

Olexandra Pertko, Yuliya Voloshyna, Lyubov Patrylak, Angela Yakovenko

Version 1 posted 20 May 2024

68

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Physical Chemistry

Working Paper

Real-space Observation of a Transition Metal Complex Dissociation and Energy Redistribution

Aviad Schori, Elisa Biasin, Ambar Banerjee, Sébastien Boutet, Philip H. Bucksbaum, Sergio Carbajo, Kelly J. Gaffney, James Glownia, Robert Hartsock, Kathryn Ledbetter, Andreas Kaldun, Jason E. Koglin, Kristjan Kunnus, Thomas J. Lane, Mengning Liang, Michael P. Minitti, Jordan T. O’Neal, Robert M. Parrish, Frederic Poitevin, Jennifer M. Ruddock, Silke Nelson, Brian Stankus, Peter M. Weber, Thomas J.A. Wolf, Michael Odelius, Adi Natan

Version 1 posted 29 August 2024

238

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Inorganic Chemistry

Working Paper

A Combined Spin-Flip and IP/EA Approach for Handling Spin and Spatial Degeneracies: Application to Double Exchange Systems

Shannon Houck, Nicholas Mayhall

Version 1 posted 11 December 2018

883

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Organic Chemistry

Working Paper

Enantioselective Transition-Metal Catalysis via Anion Binding with Chiral Hydrogen-Bond Donors

Eric N. Jacobsen, John M. Ovian, Petra Vojackova

Version 1 posted 04 August 2022

1,815

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Theoretical and Computational Chemistry

Working Paper

On the Performances of Density Functionals for Open Shell First-Row Transition Metal Compounds

Yumiao Ma

Version 2 posted 26 February 2020

1,495

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Inorganic Chemistry

Working Paper

Bond Valence Sum: A Powerful Tool for Determination of Oxidation States of Metal Ions in Coordination Compounds

Tu Nguyen

Version 1 posted 19 May 2020

3,763

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1

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11 results in Transition Metal in Keywords: Transition Metal

External Photosensitizer Free Function-Integrated Cu(II)-Complex Catalyzed Photo Driven CO2 Reduction

Reactions of Aluminium(I) with Transition Metal Carbonyls: Scope, Mechanism and Selectivity of CO Homologation

The tmQM Dataset - Quantum Geometries and Properties of 86k Transition Metal Complexes

A Free Aluminylene with Diverse σ-Donating and Doubly σ/π-Accepting Ligand Features for Transition Metals

Oxidative CO2 dehydrogenation of butane on microspherical zeolite-containing composites based on kaolin

Real-space Observation of a Transition Metal Complex Dissociation and Energy Redistribution

A Combined Spin-Flip and IP/EA Approach for Handling Spin and Spatial Degeneracies: Application to Double Exchange Systems

Enantioselective Transition-Metal Catalysis via Anion Binding with Chiral Hydrogen-Bond Donors

On the Performances of Density Functionals for Open Shell First-Row Transition Metal Compounds

Bond Valence Sum: A Powerful Tool for Determination of Oxidation States of Metal Ions in Coordination Compounds

11 results in Keywords: Transition Metal