Taner Yildirim

Integrating Crystallographic and Computational Approaches to Carbon-Capture Materials for the Mitigation of Climate Change

August 27, 2024

Author(s)

Eric J. Cockayne, Austin McDannald, Winnie Wong-Ng, Yu-Sheng Chen, Felipe Gándara Barragán, Jason Benedict, Christopher H. Hendon, David A. Keen, Ute Kolb, Lan Li, Shengqian Ma, William Morris, Aditya Nandy, Tomče Runčevski, Mustapha Soukri, Anuroop Sriram, Janice A. Steckel, John Findley, Chris Wilmer, Taner N. Yildirim, Wei Zhou, Igor Levin, Craig Brown

This article presents an overview of the current state of the art in the structure determination of microporous carbon-capture materials, as discussed at the

Construction of Highly Porous and Robust Hydrogen-Bonded Organic Framework for High-Capacity Clean Energy Gas Storage

August 13, 2024

Author(s)

Jia-Xin Wang, Xu Zhang, Changhao Jiang, Teng-Fei Zhang, Jiyan Pei, Wei Zhou, Taner N. Yildirim, Banglin Chen, Guodong Qian, Bin Li

Development of highly porous and robust hydrogen-bonded organic frameworks (HOFs) for high-pressure methane and hydrogen storage remains a grand challenge due

Unraveling Thermally Regulated Gating Mechanisms in TPT Pore-Partitioned MOF-74: A Computational Endeavor

August 7, 2024

Author(s)

Gavin McCarver, Morgan Kramer, Taner N. Yildirim, Wei Zhou

In the pursuit of advanced gas adsorption materials, we investigate the thermally activated gating mechanism of functionalized TPT (2,4,6-tri(4-pyridyl)-1,3,5

Controlling the CO2 Reduction Reaction through Dual-Atom Catalysts Embedded in Expanded Porphyrins: A DFT Study

June 10, 2024

Author(s)

Gavin McCarver, Taner N. Yildirim, Wei Zhou

In the pursuit of innovative molecular catalysts for the electrocatalytic reduction of CO2, we employed computational methodologies to investigate six Cu-based

Water-Enhanced CO2 Capture with Molecular Salt Sodium Guanidinate

June 3, 2024

Author(s)

Hayden Evans, Marcus Carter, Wei Zhou, Taner N. Yildirim, Craig Brown, Hui Wu

Solid-state amine absorbent materials, including those containing guanidine derivatives, have received tremendous attention as the world combats the challenges

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Taner Yildirim (Fed)

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