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Inorganic Chemistry

Working Paper

On the Crystal Chemistry of Inorganic Nitrides: Crystal-Chemical Parameters, Bonding Behavior, and Opportunities in the Exploration of Their Compositional Space

Olivier Charles Gagné

Version 4 posted 02 November 2020

1,156

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Theoretical and Computational Chemistry

Working Paper

Enumeration of de novo Inorganic Complexes for Chemical Discovery and Machine Learning

Stefan Gugler, Jon Paul Janet, Heather Kulik

Version 1 posted 17 June 2019

729

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Theoretical and Computational Chemistry

Working Paper

The Role of the Active Site Tyrosine in the Mechanism of Lytic Polysaccharide Monooxygenase

Aina McEvoy, Joel Creutzberg, Raushan Kumar Singh, Morten J. Bjerrum, Erik Hedegård

Version 1 posted 18 March 2020

512

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Inorganic Chemistry

Working Paper

Reversible Switching of Organic Diradical Character via Iron-Based Spin-crossover

Airi Kawamura, Jiaze Xie, Jan-Niklas Boyn, Kate Jesse, Andrew McNeece, Ethan A. Hill, Kelsey Collins, Juan Valdez-Morreira, Alexander S. Filatov, Josh W. Kurutz, David A. Mazziotti, John Anderson

Version 1 posted 10 August 2020

635

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Inorganic Chemistry

Working Paper

H2 Evolution from H2O via O–H Oxidative Addition Across a 9,10-Diboraanthracene

Jordan W. Taylor, William Harman

Version 1 posted 03 August 2020

398

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Inorganic Chemistry

Working Paper

The Earth Mover’s Distance as a Metric for the Space of Inorganic Compositions

Cameron Hargreaves, Matthew Dyer, Michael Gaultois, Vitaliy Kurlin, Matthew J Rosseinsky

Version 1 posted 10 August 2020

722

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Theoretical and Computational Chemistry

Working Paper

Density Functional Approximations for Consistent Spin and Oxidation States of Oxoiron Complexes

Filip Vlahovic, Maja Gruden, Stepan Stepanović, Marcel Swart

Version 1 posted 22 July 2019

888

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Chemical Education

Working Paper

La Chimie en Couleurs: Socially-Relevant and Original Research in Chemistry at High-Schools Using Modest Resources

Thibaud Rossel, Marc Creus

Version 1 posted 29 November 2018

696

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Chemical Education

Working Paper

Multiweek Experiments for an Inorganic Chemistry Laboratory Course: Synthesis of Nickel Complexes Supported by a Tetradentate Ligand with an N2O2 Donor Set

Joel Collett, Jeanette Krause, Hairong Guan

Version 1 posted 26 August 2020

947

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Chemical Education

Working Paper

Covalent d-Block Organometallics: Teaching Lewis Structures and sd/sd2 Hybridization Gives Students Additional Explanations and Powerful Predictive Tools

Ulrich Fekl

Version 1 posted 17 March 2021

1,303

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16 results in Inorganic chemistry in Keywords: Inorganic chemistry

On the Crystal Chemistry of Inorganic Nitrides: Crystal-Chemical Parameters, Bonding Behavior, and Opportunities in the Exploration of Their Compositional Space

Enumeration of de novo Inorganic Complexes for Chemical Discovery and Machine Learning

The Role of the Active Site Tyrosine in the Mechanism of Lytic Polysaccharide Monooxygenase

Reversible Switching of Organic Diradical Character via Iron-Based Spin-crossover

H2 Evolution from H2O via O–H Oxidative Addition Across a 9,10-Diboraanthracene

The Earth Mover’s Distance as a Metric for the Space of Inorganic Compositions

Density Functional Approximations for Consistent Spin and Oxidation States of Oxoiron Complexes

La Chimie en Couleurs: Socially-Relevant and Original Research in Chemistry at High-Schools Using Modest Resources

Multiweek Experiments for an Inorganic Chemistry Laboratory Course: Synthesis of Nickel Complexes Supported by a Tetradentate Ligand with an N2O2 Donor Set

Covalent d-Block Organometallics: Teaching Lewis Structures and sd/sd2 Hybridization Gives Students Additional Explanations and Powerful Predictive Tools

16 results in Keywords: Inorganic chemistry