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Catalyst Design in Nitrate Removal
Based on the volcano plot developed by Dr. Goldsmith group (Report linked in submission), we utilized DFT (density functional theory) calculations to search for bimetallic materials in the application of catalysts in aqueous nitrate removal. The calculations are conducted via the ...
Wang, D. and Jain, A. Lawrence Berkeley National Laboratory
Dec 01, 2021
7 Resources
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7 Resources
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National Occupational Estimates 2023
This dataset provides occupational staffing patterns and proportional estimates across sub-sectors tracked by the US Energy Employment Report (USEER), including Advanced Natural Gas, Bioenergy, CHP, Coal, Geothermal, Land-Based Wind, Low-Impact Hydro, Natural Gas, Nuclear, Oil, Of...
Wegner Guilfoyle, K. National Laboratory of the Rockies (NLR)
Apr 13, 2026
2 Resources
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2 Resources
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Heterostructural Rocksalt-Wurtzite Interfaces
Data and code accompanying the following publication: Sharad Mahatara and Stephan Lany, "Heterostructural interface engineering for ultrawide gap nitrides from first principles: TaC/AlN and TaC/GaN rocksalt-wurtzite interfaces," Physical Review Applied 22, 054044 (2024). http...
Mahatara, S. and Lany, S. National Renewable Energy Laboratory
Oct 23, 2024
4 Resources
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4 Resources
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WaterTAP-REFLO Simulations of Solar Energy Integrated Desalination Systems for KBHDP and Permian Basin Case Studies
This submission includes model simulations for several solar-integrated desalination water treatment systems. The simulations revolve around two different case studies: Kay Bailey Hutchinson Desalination Plant (KBHDP) and Permian Basin Produced Water (Permian)
There is one folder...
Sitterley, K. et al National Renewable Energy Laboratory
Aug 01, 2025
5 Resources
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5 Resources
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High Throughput Experimental Materials Database
The mission of the High Throughput Experimental Materials Database (HTEM DB) is to enable discovery of new materials with useful properties by releasing large amounts of high-quality experimental data to public. The HTEM DB contains information about materials obtained from high-t...
Zakutayev, A. et al National Renewable Energy Laboratory
Oct 13, 2017
2 Resources
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2 Resources
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NREL 25-cm2 High-Pressure Low-Temperature Electrolysis Cell Hardware (Open Source)
This data resource describes an open-source cell hardware that enables low temperature electrolysis (LTE) testing at elevated pressures. Existing commercial options have several downsides when it comes to R&D testing. They are often not designed for repeated reassembly, may no...
Wrubel, J. et al National Renewable Energy Laboratory
Nov 14, 2023
2 Resources
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2 Resources
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Organic Photovoltaic (OPV) Database
A database of quantum mechanical calculations on organic photovoltaic candidate molecules. Related Publications: Peter C. St. John, Caleb Phillips, Travis W. Kemper, A. Nolan Wilson, Michael F. Crowley, Mark R. Nimlos, Ross E. Larsen. (2018) Message-passing neural networ...
St. John, P. National Renewable Energy Laboratory
Apr 10, 2024
8 Resources
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8 Resources
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