Pinned Repositories
aiida-atomistic
AiiDA plugin which contains data and methods for atomistic simulations.
aiida-core
The official repository for the AiiDA code
aiida-firecrest
AiiDA Transport/Scheduler plugins for interfacing with FirecREST (https://products.cscs.ch/firecrest/)
aiida-registry
Find plugins for AiiDA
aiida-submission-controller
Some classes to help managing large number of submissions, while controlling the maximum number of submissions running at any given time
aiida-tutorials--forked
AiiDA tutorials web site
aiida-website
The primary website for AiiDA
aiida-workgraph
Efficiently design and manage flexible workflows with AiiDA, featuring an interactive GUI, checkpoints, provenance tracking, and remote execution capabilities.
disk-objectstore
An implementation of an efficient "object store" (actually, a key-value store) writing files on disk and not requiring a running server
LTB-Symm
LTB-Symm is a publicly available code that does two things: large scale tight-binding (LTB) calculation of 2D materials, and checks topological symmetries (Symm) of their wave functions.
khsrali's Repositories
khsrali/LTB-Symm
LTB-Symm is a publicly available code that does two things: large scale tight-binding (LTB) calculation of 2D materials, and checks topological symmetries (Symm) of their wave functions.
khsrali/aiida-atomistic
AiiDA plugin which contains data and methods for atomistic simulations.
khsrali/aiida-core
The official repository for the AiiDA code
khsrali/aiida-firecrest
AiiDA Transport/Scheduler plugins for interfacing with FirecREST (https://products.cscs.ch/firecrest/)
khsrali/aiida-registry
Find plugins for AiiDA
khsrali/aiida-submission-controller
Some classes to help managing large number of submissions, while controlling the maximum number of submissions running at any given time
khsrali/aiida-tutorials--forked
AiiDA tutorials web site
khsrali/aiida-website
The primary website for AiiDA
khsrali/aiida-workgraph
Efficiently design and manage flexible workflows with AiiDA, featuring an interactive GUI, checkpoints, provenance tracking, and remote execution capabilities.
khsrali/disk-objectstore
An implementation of an efficient "object store" (actually, a key-value store) writing files on disk and not requiring a running server
khsrali/Sorella_MD
khsrali/disk-objectstore-feedstock
A conda-smithy repository for disk-objectstore.
khsrali/kiwipy
A python messaging library for RPC, task queues and broadcasts
khsrali/plumpy
A python workflows library that supports writing Processes with a well defined set of inputs and outputs that can be strung together.
khsrali/pyfirecrest
Python wrappers for the FirecREST API