Role of Water Solvation on the Key Intermediates Catalyzing Oxygen Evolution on RuO2 by Di Liberto, Giovanni, Pacchioni, Gianfranco, Shao-Horn, Yang, Giordano, Livia

Get full text

Mechanistic insights into the origin of the oxygen migration barrier by Vivona, Daniele, Gordiz, Kiarash, Meyer, Randall, Raman, Sumathy, Shao-Horn, Yang

Get full text

Metal-organic architectures driven by a multifunctional 6-aminouracil spacer : structures, noncovalent interactions, and conductivity by Purkayastha, Atanu, Dhar, Sourab, Mondal, Suvra Prakash, Franconetti, Antonio, Frontera, Antonio, Ganguly, Rakesh, Kirillov, Alexander M., Misra, Tarun Kumar

Get full text

Cation-Dependent Multielectron Kinetics of Metal Oxide Splitting by Lunger, Jaclyn R., Lutz, Naomi, Peng, Jiayu, Bajdich, Michal, Shao-Horn, Yang

Get full text

Electrolyte Dependence of Li+ Transport Mechanisms in Small Molecule Solvents from Classical Molecular Dynamics by Crabb, Emily, Aggarwal, Abhishek, Stephens, Ryan, Shao-Horn, Yang, Leverick, Graham, Grossman, Jeffrey C.

Get full text

A cross-scale framework for evaluating flexibility values of battery and fuel cell electric vehicles by Liu, Ruixue, He, Guannan, Wang, Xizhe, Mallapragada, Dharik, Zhao, Hongbo, Shao-Horn, Yang, Jiang, Benben

Get full text

Alkali Metal Salt Interference on the Salicylate Method for Quantifying Ammonia from Nitrogen Reduction by Giner-Sanz, Juan José, Leverick, Graham M., Giordano, Livia, Pérez-Herranz, Valentín, Shao-Horn, Yang

Get full text

Examining graph neural networks for crystal structures: Limitations and opportunities for capturing periodicity by Gong, Sheng, Yan, Keqiang, Xie, Tian, Shao-Horn, Yang, Gomez-Bombarelli, Rafael, Ji, Shuiwang, Grossman, Jeffrey C.

Get full text

Carbon–cement supercapacitors as a scalable bulk energy storage solution by Chanut, Nicolas, Stefaniuk, Damian, Weaver, James C., Zhu, Yunguang, Shao-Horn, Yang, Masic, Admir, Ulm, Franz-Josef

Get full text

Calibrating DFT Formation Enthalpy Calculations by Multifidelity Machine Learning by Gong, Sheng, Wang, Shuo, Xie, Tian, Chae, Woo Hyun, Liu, Runze, Shao-Horn, Yang, Grossman, Jeffrey C.

Get full text

The low overpotential regime of acidic water oxidation part II: trends in metal and oxygen stability numbers by Scott, Soren B., Sørensen, Jakob E., Rao, Reshma R., Moon, Choongman, Kibsgaard, Jakob, Shao-Horn, Yang, Chorkendorff, Ib

Get full text

21W.730-1 Imagining the Future, Spring 2004 by Faery, Rebecca Blevins

Subjects: “…Turn-of-the-century…”
Get full text

Chemistry-Informed Machine Learning for Polymer Electrolyte Discovery by Bradford, Gabriel, Lopez, Jeffrey, Ruza, Jurgis, Stolberg, Michael A., Osterude, Richard, Johnson, Jeremiah A., Gomez-Bombarelli, Rafael, Shao-Horn, Yang

Get full text

Iridium Oxide Coordinatively Unsaturated Active Sites Govern the Electrocatalytic Oxidation of Water by Velasco Vélez, Juan Jesús, Bernsmeier, Denis, Mom, Rik V., Zeller, Patrick, Shao‐Horn, Yang, Roldan Cuenya, Beatriz, Knop‐Gericke, Axel, Schlögl, Robert, Jones, Travis E.

Get full text

Uniting activity design principles of anode catalysts for direct liquid fuel cells by Zheng, Daniel J, Peng, Jiayu, McCormack, Kaylee, Xu, Hongbin, Kang, Jin Soo, Wang, Zhenshu, Ren, Zhichu, Li, Ju, Román-Leshkov, Yuriy, Shao-Horn, Yang

Get full text

Platinum/Tantalum Carbide Core–Shell Nanoparticles with Sub‐Monolayer Shells for Methanol and Oxygen Electrocatalysis by Wang, Zhenshu, Kang, Jin Soo, Göhl, Daniel, Paciok, Paul, Gonçalves, Danelle S., Lim, Hyung‐Kyu, Zanchet, Daniela, Heggen, Marc, Shao‐Horn, Yang, Ledendecker, Marc, Román‐Leshkov, Yuriy

Get full text

Exploring TNFi drug-levels and anti-drug antibodies during tapering among patients with inflammatory arthritis: secondary analyses from the randomised BIODOPT trial by Uhrenholt, L, Sørensen, MER, Lauridsen, KB, Duch, K, Dreyer, L, Christensen, R, Hauge, E-M, Loft, AG, Rasch, MNB, Horn, HC, Taylor, PC, Nielsen, KR, Kristensen, S

Deep brain stimulation of the hypothalamic region: a systematic review by Mofatteh, M, Mohamed, A, Mashayekhi, MS, Skandalakis, GP, Neudorfer, C, Arfaie, S, MohanaSundaram, A, Sabahi, M, Anand, A, Aboulhosn, R, Liao, X, Horn, A, Ashkan, K

A cloud platform for sharing and automated analysis of raw data from high throughput polymer MD simulations by Xie, Tian, Kwon, Ha-Kyung, Schweigert, Daniel, Gong, Sheng, France-Lanord, Arthur, Khajeh, Arash, Crabb, Emily, Puzon, Michael, Fajardo, Chris, Powelson, Will, Shao-Horn, Yang, Grossman, Jeffrey C.

Get full text

Accelerating amorphous polymer electrolyte screening by learning to reduce errors in molecular dynamics simulated properties by Xie, Tian, France-Lanord, Arthur, Wang, Yanming, Lopez, Jeffrey, Stolberg, Michael A., Hill, Megan, Leverick, Graham Michael, Gomez-Bombarelli, Rafael, Johnson, Jeremiah A., Shao-Horn, Yang, Grossman, Jeffrey C.

Get full text