Repositories list

• dfnWorks

  Public
  dfnWorks is a parallelized computational suite to generate three-dimensional discrete fracture networks (DFN) and simulate flow and transport. If you download the software please fill out our interest form to stay up to date on releases https://goo.gl/forms/VE39oKsyp4LVC6Gj2 and join our google group https://groups.google.com/d/forum/dfnworks-users

  transportsimulation-enginefractures+ 1subsurface-flow

  Python

  •

  Other

  •47•82•23•0•Updated Mar 5, 2025Mar 5, 2025

• singularity-eos

  Public
  Performance portable equations of state and mixed cell closures

  C++

  •

  BSD 3-Clause "New" or "Revised" License

  •11•29•67•8•Updated Mar 5, 2025Mar 5, 2025

• BEE

  Public
  Python

  •

  Other

  •3•17•131•7•Updated Mar 5, 2025Mar 5, 2025

• Fierro

  Public
  Fierro is a C++ code designed to aid the research and development of numerical methods, testing of user-specified models, and creating multi-scale models related to quasi-static solid mechanics and compressible material dynamics using low- and high-order meshes.

  engineeringparallel-computingcomputational-mechanics+ 9material-sciencetopology-optimizationshock-capturingfinite-element-methodslagrangiancrystal-plasticitylagrangian-mechanics+ 2

  C++

  •

  BSD 3-Clause "New" or "Revised" License

  •17•42•16•5•Updated Mar 5, 2025Mar 5, 2025

• dsi

  Public
  LANL Data Science Infrastructure Project

  Python

  •5•5•29•2•Updated Mar 5, 2025Mar 5, 2025

• scico

  Public
  Scientific Computational Imaging COde

  optimizationadmmproximal-algorithms+ 8proximal-operatorsinverse-problemsconvex-optimizationcomputational-imagingfistatotal-variationjax+ 1

  Python

  •

  BSD 3-Clause "New" or "Revised" License

  •18•115•23•2•Updated Mar 5, 2025Mar 5, 2025

• ports-of-call

  Public
  Performance Portability Utilities

  C++

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  BSD 3-Clause "New" or "Revised" License

  •2•5•10•1•Updated Mar 5, 2025Mar 5, 2025

• Nautilus

  Public
  A collection of useful utilities for simulating nuclear reactions and related applications.

  CMake

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  Other

  •0•0•0•0•Updated Mar 4, 2025Mar 4, 2025

• flecsolve

  Public
  FleCSI Linear Algebra Package

  C++

  •

  Other

  •0•1•0•0•Updated Mar 4, 2025Mar 4, 2025

• phoebus

  Public
  Phifty One Ergs Blows Up A Star

  Jupyter Notebook

  •

  BSD 3-Clause "New" or "Revised" License

  •2•47•39•14•Updated Mar 4, 2025Mar 4, 2025

• T-ELF

  Public
  Tensor Extraction of Latent Features (T-ELF). Within T-ELF's arsenal are non-negative matrix and tensor factorization solutions, equipped with automatic model determination (also known as the estimation of latent factors - rank) for accurate data modeling. Our software suite encompasses cutting-edge data pre-processing and post-processing modules.

  machine-learninghpcgpu+ 16matrixmatrix-factorizationfeature-extractionhigh-performance-computingsemi-supervised-learningdimensionality-reductiontensor-factorization+ 9

  Python

  •

  Other

  •5•16•11•0•Updated Mar 4, 2025Mar 4, 2025

• artemis

  Public
  Astrophysical multifluid radiation hydrodynamics code

  C++

  •

  Other

  •8•23•4•8•Updated Mar 4, 2025Mar 4, 2025

• hippynn

  Public
  python library for atomistic machine learning

  machine-learninglibraryatomistic-models+ 3graph-neural-networksatomistic-machine-learninginteratomic-potentials

  Python

  •

  Other

  •24•73•10•4•Updated Mar 4, 2025Mar 4, 2025

• LaGriT

  Public
  Los Alamos Grid Toolbox (LaGriT) is a library of user callable tools that provide mesh generation, mesh optimization and dynamic mesh maintenance in two and three dimensions.

  meshinghydrologygeology+ 2delaunay-triangulationgrid

  Fortran

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  Other

  •49•122•123•4•Updated Mar 4, 2025Mar 4, 2025

• nuDustC

  Public
  Nucleating Dust Code in C++

  C++

  •

  BSD 3-Clause "New" or "Revised" License

  •1•0•3•0•Updated Mar 3, 2025Mar 3, 2025

• libquo

  Public
  Dynamic execution environments for coupled, thread-heterogeneous MPI+X applications

  hpcopenmppthreads+ 7threadingmpi-plus-xmpixhardware-localitympihwlocmpi-applications

  C

  •

  BSD 3-Clause "New" or "Revised" License

  •9•21•4•2•Updated Mar 3, 2025Mar 3, 2025

• PLEIADES

  Public
  PLEIADES: Python Library Extensions for Isotopic Analysis via Detailed Examination of SAMMY results

  Python

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  Other

  •4•3•2•2•Updated Mar 3, 2025Mar 3, 2025

• qmd-progress

  Public
  PROGRESS: Parallel, Rapid O(N) and Graph-based Recursive Electronic Structure Solver.

  hpcparallelmpi

  Fortran

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  Other

  •13•21•18•4•Updated Mar 3, 2025Mar 3, 2025

• MultiPEM_Toolbox

  Public
  Multi-phenomenology characterization of explosive devices

  R

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  BSD 3-Clause "New" or "Revised" License

  •0•1•0•0•Updated Mar 2, 2025Mar 2, 2025

• not-quite-transcendental

  Public
  Reference Implementations of Not-Quite-Transcendental Functions

  TeX

  •

  BSD 3-Clause "New" or "Revised" License

  •0•4•0•0•Updated Feb 28, 2025Feb 28, 2025

• Yoke

  Public
  System for prototyping, training, and testing of deep ML models

  0•0•0•0•Updated Feb 28, 2025Feb 28, 2025

• chemostat_regression

  Public
  Automatically detect chemostat optical density dilution cycles and calculate growth rate regression slopes.

  R

  •

  BSD 3-Clause "New" or "Revised" License

  •0•0•0•0•Updated Feb 28, 2025Feb 28, 2025

• bml

  Public
  The Basic Matrix Library (bml)

  C

  •

  Other

  •19•40•0•0•Updated Feb 27, 2025Feb 27, 2025

• FEHM

  Public
  Finite Element Heat and Mass Transfer Code

  earth-sciencesimulation-modelinggroundwater-modelling+ 11porous-flowreactive-chemistrycoupled-heat-massmultiphase-transportcarbon-storagesoil-vaporcarbon-sequestration+ 4

  GLSL

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  Other

  •19•57•34•3•Updated Feb 26, 2025Feb 26, 2025

• Architector

  Public
  The architector python package - for 3D metal complex design. C22085

  molecular-structurescomputational-chemistrymolecular-simulation+ 4d-blockactinideslanthanidesrare-earth-elements

  Python

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  Other

  •7•42•2•1•Updated Feb 26, 2025Feb 26, 2025

• NEONiso

  Public
  R package for calibrating NEON atmospheric isotope data

  R

  •

  GNU General Public License v3.0

  •2•2•11•0•Updated Feb 26, 2025Feb 26, 2025

• spiner

  Public
  Performance portable routines for generic, tabulated, multi-dimensional data

  C++

  •

  BSD 3-Clause "New" or "Revised" License

  •4•7•8•3•Updated Feb 25, 2025Feb 25, 2025

• iMMD

  Public
  Iterative Multiscale Molecular Dynamics in OpenMM: Accelerating Conformational Sampling of Biomolecular Systems by Iterating All-Atom and Coarse-Grained Molecular Dynamics Simulations

  Python

  •0•0•0•0•Updated Feb 25, 2025Feb 25, 2025

• fluxnet-sentinels

  Public
  Eddy covariance towers as sentinels of abnormal radioactive material releases

  pythonmanuscript

  TeX

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  MIT License

  •0•0•0•0•Updated Feb 24, 2025Feb 24, 2025

• NNFDivergence

  Public
  F-divergence regularization for neural networks

  MIT License

  •0•0•0•0•Updated Feb 21, 2025Feb 21, 2025