Ole Schütt (oschuett)

oschuett

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cp2k

Ole Schütt's repositories

appmode

A Jupyter extensions that turns notebooks into web applications.

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jupmatcloud_apps

Turn-key solutions for the Materials Cloud

appmode-feedstock

A conda-smithy repository for appmode.

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cp2k

Quantum chemistry and solid state physics software package

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molview-ipywidget

MolView's Sketcher as an IPython Widget

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SIRIUS

Domain specific library for electronic structure calculations

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aiida-cp2k

The CP2K plugin for the AiiDA workflow and provenance engine.

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c-libtorch

Experimental C binding for libtorch

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cp2k-migration-scripts

Scripts to migrate CP2K from SVN to Git

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dbcsr

DBCSR: Distributed Block Compressed Sparse Row matrix library

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dft-transport

Quantum transport library with DFT, coupled to CP2K

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dokuwiki_plugin_logautherror

Plugin dokuwiki: when an authentification fail log in apache log_error. Use it with fail2ban !

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e3nn

A modular framework for neural networks with Euclidean symmetry

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fprettify

auto-formatter for modern fortran source code

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fypp

Python powered Fortran preprocessor

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ketcher

Web-based molecule sketcher

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keystone_babel

A proxy for OpenStack Keystone that hides exotic identity providers

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lie_learn

Computations involving Lie groups and harmonic analysis

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pao_ml_equivar

PAO-ML powered by Equivariant Neural Networks

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rclone

"rsync for cloud storage" - Google Drive, Amazon Drive, S3, Dropbox, Backblaze B2, One Drive, Swift, Hubic, Cloudfiles, Google Cloud Storage, Yandex Files

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webcalendar

WebCalendar is a PHP application used to maintain a calendar for a single user or an intranet group of users. It can also be configured as an event calendar.

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