Pinned Repositories
polyhedral-template-matching
Polyhedral Template Matching algorithm for analysis of molecular dynamics simulation data
schiotz's Repositories
schiotz/polyhedral-template-matching
Polyhedral Template Matching algorithm for analysis of molecular dynamics simulation data
schiotz/abTEM
ab initio Transmission Electron Microscopy
schiotz/asap-feedstock
A conda-smithy repository for asap.
schiotz/atomic-resolution-tensorflow
A deep learning algorithm for identifying structures in atomic-resolution images
schiotz/beam_induced_heating
Scripts for the article "Beam induced heating in electron microscopy modeled with machine learning interatomic potentials"
schiotz/DTU_10122
Notebooks for DTU course 10122 Statistical Physics
schiotz/DTU_10316
schiotz/easybuild-easyblocks
Collection of easyblocks that implement support for building and installing software with EasyBuild.
schiotz/easybuild-easyconfigs
A collection of easyconfig files that describe which software to build using which build options with EasyBuild.
schiotz/GPAW-benchmark-2023
schiotz/nequip
NequIP is a code for building E(3)-equivariant interatomic potentials
schiotz/Niflheim_system
System technical documentation for Niflheim
schiotz/PyQSTEM
A Python interface to the electron microscopy simulation program QSTEM
schiotz/pyqstem-feedstock
A conda-smithy repository for pyqstem.
schiotz/staged-recipes
A place to submit conda recipes before they become fully fledged conda-forge feedstocks
schiotz/structural-template-matching