Daniel H. Ess

According to our database, Daniel H. Ess authored at least 4 papers between 2022 and 2024.

Collaborative distances:

• Dijkstra number of seven.
• Erdős number of seven.

2024

Machine Learning Models for Predicting Zirconocene Properties and Barriers.

Justin K. Kirkland, Jugal Kumawat, Maliheh Shaban Tameh, Tyson Tolman, Allison C. Lambert, Graham R. Lief, Qing Yang, Daniel H. Ess

J. Chem. Inf. Model., 2024

2023

ReaLigands: A Ligand Library Cultivated from Experiment and Intended for Molecular Computational Catalyst Design.

Shu-Sen Chen, Zack Meyer, Brendan Jensen, Alex Kraus, Allison C. Lambert, Daniel H. Ess

J. Chem. Inf. Model., December, 2023

Density functional theory and CCSD(T) evaluation of ionization potentials, redox potentials, and bond energies related to zirconocene polymerization catalysts.

Steven M. Maley, Graham R. Lief, Richard M. Buck, Orson L. Sydora, Qing Yang, Steven M. Bischof, Daniel H. Ess

J. Comput. Chem., February, 2023

2022

Demonstration of High-Throughput Building Block and Composition Analysis of Metal-Organic Frameworks.

Bo Yang, David Hawley, Jianhua Yao, Camille May, Jose E. Mendez-Arroyo, Daniel H. Ess

J. Chem. Inf. Model., 2022