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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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Strengthening of Calcite Assemblages through Chemical Complexation Reaction Experimental Data
Experimental data for manuscript "Strengthening of Calcite Assemblages through Chemical Complexation Reaction" by R. C. Choens, J. Wilson, and A. G. Ilgen; Sandia National Laboratories. The data includes scanning electron microscope images of various calcite assemblages along with...
Choens, R. et al Sandia National Laboratories
Feb 04, 2021
11 Resources
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11 Resources
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Reverse Osmosis Simulation Data
This dataset consists of computational fluid dynamics (CFD) output for various spacer configurations in a feed-water channel in reverse osmosis (RO) applications. Feed-water channels transport brine solution to the RO membrane surfaces. The spacers embedded in the channels help im...
Nadakkal Appukuttan, S. et al National Renewable Energy Lab NREL
Apr 22, 2024
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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). https://...
Mahatara and LanyNational Renewable Energy Laboratory
Oct 23, 2024
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4 Resources
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The Urban Energy-Water Nexus: Utility-Level Water Flows and Embedded Energy
There are limited open source data available for determining water production/treatment and required energy for cities across the United States. This database represents the culmination of a two-year effort to obtain data from cities across the United States via open records reque...
Chini, C. and Stillwell, A. University of Illinois at Urbana-Champaign
Feb 20, 2018
114 Resources
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114 Resources
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