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SRM 673 Nickel Oxide No. 3
Data provided by National Institute of Standards and Technology
Standard Reference Material 673 Nickel Oxide, No. 3 has been discontinued and is no longer being produced. The data is public in the Certificate of Analysis for this material.
Tags: Advanced Materials,
Modified: 2024-02-22
Views: 0
SRM 924a Lithium Carbonate
Data provided by National Institute of Standards and Technology
Standard Reference Material 924a Lithium Carbonate - This Standard Reference Material (SRM) is intended for use as a chemical of known purity. It is intended primarily for use in the calibration and standardization of procedures and for the routine critical evaluation of the daily working standards used in these procedures. This data is public in the Certificate of Analysis for this material.
Tags: Advanced Materials,
Modified: 2024-02-22
Views: 0
SRM 1877 Beryllium Oxide Powder
Data provided by National Institute of Standards and Technology
SRM 1877 Beryllium Oxide Powder - This Standard Reference Material (SRM) is intended for use in laboratory analysis and health research for the development and validation of analytical methods and instruments used to determine beryllium, as well as for proficiency testing of laboratories involved in beryllium determinations. A unit of SRM 1877 consists of one bottle containing 20 g of beryllium oxide powder. This data is public in the Certificate of Analysis for this material.
Tags: Advanced Materials,
Modified: 2024-02-22
Views: 0
NanoUV-VIS- An interactive visualization tool for monitoring the evolution of optical properties of nanoparticles throughout synthesis reactions.
Data provided by National Institute of Standards and Technology
Shiny app for monitoring the evolution of optical properties of nanoparticles throughout synthesis reactions.
Tags: Advanced Functional Materials,Advanced Materials,
Modified: 2024-02-22
Views: 0
JARVIS: Joint Automated Repository for Various Integrated Simulations
Data provided by National Institute of Standards and Technology
JARVIS (Joint Automated Repository for Various Integrated Simulations) is a repository designed to automate materials discovery using classical force-field, density functional theory, machine learning calculations and experiments.
The Force-field section of JARVIS (JARVIS-FF) consists of thousands of automated LAMMPS based force-field calculations on DFT geometries. Some of the properties included in JARVIS-FF are energetics, elastic constants, surface energies, defect formations energies and phonon frequencies of materials.
Tags: Density functional theory,classical interatomic potential,force-field,python,JARVIS,MGI,MDCS,RESTAPI,automation,
Modified: 2024-02-22
Views: 0
FEASST: Free Energy and Advanced Sampling Simulation Toolkit
Data provided by National Institute of Standards and Technology
The Free Energy and Advanced Sampling Simulation Toolkit (FEASST) is a free, open-source, modular program to conduct molecular and particle-based simulations with flat-histogram Monte Carlo and molecular dynamics methods. It is a software written in C++ and python which is made publicly available to aid in reproducibility. It is also provided as a service to the scientific community in which there are few , if any, Monte Carlo programs that support flat histogram methods and advanced sampling algorithms. This software is expected to be updated frequently with new methods.
Tags: monte carlo,molecular simulation,free energy,flat histogram,C++,python,
Modified: 2024-02-22
Views: 0
Source of the Refl1d program for modeling and analyzing neutron and X-ray reflectometry data, with the addition of distributed roughness capability.
Data provided by National Institute of Standards and Technology
Source of the Refl1d program for modeling and analyzing neutron and X-ray reflectometry data, with the addition of distributed roughness capability.
Tags: neutron scattering,reflectometry,polarized,Bayesian,roughness,python,
Modified: 2024-02-22
Views: 0
pyPRISM: A Computational Tool for Liquid State Theory Calculations of Macromolecular Materials
Data provided by National Institute of Standards and Technology
Polymer Reference Interaction Site Model (PRISM) theory describes the equilibrium spatial-correlations of liquid-like polymer systems including melts, blends, solutions, block copolymers, ionomers, liquid crystal forming polymers and nanocomposites. Using PRISM theory, one can calculate thermodynamic (e.g., second virial coefficients, Flory-Huggins interaction parameters, potentials of mean force) and structural (eg., pair correlation functions, structure factors) information for these macromolecular materials.
Tags: polymer,theory,liquid-state theory,python,polymer nanocomposite,polymer solution,X-ray scattering,neutron scattering,software,tool,computation,
Modified: 2024-02-22
Views: 0
NIST Inorganic Crystal Structure Database (ICSD)
Data provided by National Institute of Standards and Technology
Materials discovery and development necessarily begins with the preparation and identification of product phase(s). Crystalline compounds can be identified by their characteristic diffraction patterns using X-rays, neutrons, and or electrons. An estimated 20,000 X-ray diffractometers and a comparable number of electron microscopes are used daily in materials research and development laboratories for this purpose.
Tags: chemical structures,crystallography,crystal structures,diffraction,disorder,electrons,identification,inorganic,neutrons,magnetic,metals,minerals,materials,Rietveld,synchrotron,twinned,x-rays,Advanced Materials,manufacturing,Safety,Security and Forensics,
Modified: 2024-02-22
Views: 0
Hestia Fossil Fuel Carbon Dioxide Emissions Inventory for Los Angeles Basin
Data provided by National Institute of Standards and Technology
Hestia Project quantifies, simulates and visualizes greenhouse gases such as carbon dioxide emitted in urban regions. Los Angeles basin activity is provided at the 1 km grid spatial resolution, and at temporal resolutions of hourly or annually. Hestia-LA urban CO2 emissions inventory builds upon work conducted at the national scale (Vulcan Project) that includes various sectorial attributions. Hestia's high spatial and temporal resolution datasets are currently available for 2010 to 2015, in UTC or local time.
Tags: Greenhouse Gas,carbon dioxide,CO2,Urban Emissions,Carbon Monitoring,Atmospheric Modeling,Los Angeles Basin,California,Megacities,Fossil Fuel,Bottom-up Emissions Inventory,
Modified: 2024-02-22
Views: 0