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Found 384 dataset(s) matching "force fields".
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CHIPS-FF (Computational High-Performance Infrastructure for Predictive Simulation-based Force Fields) is a universal, open-source benchmarking platform for machine learning force fields (MLFFs)....
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These data and the coarse-grain force-field parameters were used to produce publication (1) "Structure-dilute property relationships of comb-like macromolecules in a good solvent" by Robert J. S....
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This data set contains the primary forcing hourly data "File A" for Phase 2 of the North American Land Data Assimilation System (NLDAS-2). The data are in 1/8th degree grid spacing and range from...
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This data set contains the secondary forcing hourly data "File B" for Phase 2 of the North American Land Data Assimilation System (NLDAS-2). The data are in 1/8th degree grid spacing and range...
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JARVIS (Joint Automated Repository for Various Integrated Simulations) is a repository designed to automate materials discovery using classical force-field, density functional theory, machine...
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This data set contains the monthly secondary forcing data "File B" for Phase 2 of the North American Land Data Assimilation System (NLDAS-2). The data are in 1/8th degree grid spacing and range...
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This data product contains the monthly primary forcing data "File A" for Phase 2 of the North American Land Data Assimilation System (NLDAS-2). The data are in 1/8th degree grid spacing and range...
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This repository provides a source for interatomic potentials (force fields), related files, and evaluation tools to help researchers obtain interatomic models and judge their quality and...
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In this dataset offspring are assigned to a dam and sire using information from single nucleotide polymorphisms (SNPs) from previously published pedigree reassignments of Brown Treesnakes within...
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With the upgraded Land Surface Models (LSMs) and updated forcing data sets, the GLDAS version 2.1 (GLDAS-2.1) production stream serves as a replacement for GLDAS-001. The entire GLDAS-001...
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In 2024 the U.S. Geological Survey (USGS), in cooperation with the Air Force Civil Engineer Center (AFCEC), conducted geophysical surveys at Hanscom Air Force Base, Hanscom Field, and surrounding...
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This data set provides South American Land Data Assimilation System (SALDAS) forcing data including atmospheric fields necessary for land surface modeling for South America which are derived by...
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Background Molecular mechanics (MM) and quantum chemical (QM) calculations are widely applied and powerful tools for the stereochemical and conformational investigations of molecules....
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JavaGenes is a fairly general purpose evolutionary software system written in Java. It implements several versions of the genetic algorithm, simulated annealing, stochastic hill climbing and other...
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Polymer Reference Interaction Site Model (PRISM) theory describes the equilibrium spatial-correlations of liquid-like polymer systems including melts, blends, solutions, block copolymers,...
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This is a python package to perform thermodynamic extrapolation andinterpolation of observables calculated from molecular simulations. This allowsfor more efficient use of simulation data for...
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This dataset contains meteorological data collected as part of the ongoing the NASA SnowEx mission, from five meteorological stations installed between 2016-2017 in Grand Mesa, Colorado, to...
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This dataset contains raw meteorological data collected as part of the ongoing the NASA SnowEx mission, from five meteorological stations installed between 2016-2017 in Grand Mesa, Colorado, to...
