Jan-Niklas Boyn

29PUBLICATIONS
38CO-AUTHORS
Theoretical quantum chemistryMetal organic frameworksBiologically active moleculesMetal cluster chemistryOrganometallic chemistry
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Publications (29)

|Sep 09, 2026
Open-source implementation of the anti-Hermitian contracted Schrödinger equation for electronic ground and excited states.

|Jul 09, 2026
Metal-bicarbonate ion pairing in alkaline aqueous solutions from multilevel embedded correlated wavefunction theory and molecular dynamics.

|Jun 11, 2026
3-Azetidinylpiperidine-4-alkylidenemalononitrile and Related Building Blocks.

|Jun 10, 2026
Holistic simulation of iron-sulfur cluster electronic and physical structures with hybrid density functional approximation reduced density matrix functional theory.

|Feb 06, 2026
Disentangling Cooperative Electron Correlation and Primary Coordination Sphere Effects in [4Fe-4S]+ Structural Isomerism and π-Acid Activation.

Shelby T Davis, Daniel Gibney, Jan-Niklas Boyn

|Jan 28, 2026
Synthesis of 1,3-Bis-trifluoromethylated (Hetero)cyclohexane-2-carboxylates from Alkylidenemalononitriles.

Morgane Mando, Akash R Gogate, Dylan J Smith

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Frequent Collaborators

11 joint publications

John S Anderson

8 joint publications

David A Mazziotti

7 joint publications

Sophie W Anferov

6 joint publications

Lauren E McNamara