-
Notifications
You must be signed in to change notification settings - Fork 0
Commit
This commit does not belong to any branch on this repository, and may belong to a fork outside of the repository.
Deploying to gh-pages from @ 0371660 🚀
- Loading branch information
Showing
194 changed files
with
35,589 additions
and
0 deletions.
There are no files selected for viewing
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
Original file line number | Diff line number | Diff line change |
---|---|---|
@@ -0,0 +1,4 @@ | ||
# Sphinx build info version 1 | ||
# This file hashes the configuration used when building these files. When it is not found, a full rebuild will be done. | ||
config: d4590b5b17ae8770b7676b3dd17d9bad | ||
tags: 645f666f9bcd5a90fca523b33c5a78b7 |
Binary file added
BIN
+12.3 KB
_images/088f468f7935c6caed9a3d51699e717f6095802da981afec9f924628bc76bd29.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+13 KB
_images/2a7b6d8d3bbb02e641a6e937679d10ba7c38a9d6a21d0314bad9f0ae42cced61.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+20.6 KB
_images/36b6c16633f5f2d124aed0f3a43aa3311e0ed370912dc11bf2071ff542d3804e.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+16.2 KB
_images/39cfbc2cae47e1f38df31186378ea9fe03b4a9d3f7cbc5d2843e1e2bf6efc67f.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+10.9 KB
_images/4a620fb0932b5513594106f6dec38903178aeebf119f91ed1921797217a7664c.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+16 KB
_images/589e7da23dc24c38fb9cb49d030961dacf783a006697e697c37bff3ba6000979.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+64.7 KB
_images/9cc5f944f76df6f129796c3a3236e94526a76f7ce4c647197811ba1653fa50ad.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+15.8 KB
_images/a635eda5874f1d6fed93591968daa49aa4f9f74e466f54247caf2685dcbe2ae6.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+21 KB
_images/a9f991d048efb289abe703fe1167b5fc2765d284f394237964e4c9c35ce31e94.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+33.5 KB
_images/af14310df205b09fecafd110b6a0d2b41b6827433a9d16b4d198d868dcdd2f6e.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+42.9 KB
_images/b98b7202dba099a8e09e1c2618b6f2d9d901f5d75338818381f68bf6f43bdda1.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+58.7 KB
_images/c6373e9957a37879fe7d06a5efffb581007818113d61dd530b096403dffa70b8.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+20.8 KB
_images/cf7b87f1dbfce920ce3eecfdfa56b6fe1d8891c2c621ef2e8eb63c8942b1513b.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+13.9 KB
_images/dad0eb6a83fbac6e0fc28e23c874bfe5d867946367a38bcb3309d79923406ca9.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+16.6 KB
_images/e3d9e9e565d48ecd5490c1eb340c1c0bcddf2beca2cf065a9cae807f2e2e77d9.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+21.6 KB
_images/eb791783b26985fc6d60d1e8384d568336a9272c7d42fcb4e40c81701c7cabd0.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Binary file added
BIN
+67.3 KB
_images/efa52e589d5d94422905b367526695f5d6ec24afa57ce6bc6eb1f0606c353f7e.png
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Loading
Sorry, something went wrong. Reload?
Sorry, we cannot display this file.
Sorry, this file is invalid so it cannot be displayed.
Oops, something went wrong.
This file contains bidirectional Unicode text that may be interpreted or compiled differently than what appears below. To review, open the file in an editor that reveals hidden Unicode characters.
Learn more about bidirectional Unicode characters
Original file line number | Diff line number | Diff line change |
---|---|---|
@@ -0,0 +1,14 @@ | ||
# <font style="color:#004A7C" face="Helvetica" > Workflows for materials science simulations with pyiron </font> | ||
|
||
Hickel, T. (Speaker)¹; Menon, S. (Speaker)¹; Waseda, O. (Speaker)¹ | ||
¹Max-Planck-Institut für Eisenforschung GmbH, Düsseldorf | ||
|
||
Presented at the NFDI-Matwerk conference on 29.06.2023 | ||
|
||
|
||
Advanced computational simulations in materials science have reached a maturity that allows one to accurately describe and predict materials properties and processes. The underlying simulation tasks often involve several different models and software that requires expert knowledge to set up a project and to vary input parameters. The accompanying increasing complexity of simulation protocols means that the workflow along the simulation chain becomes an integral part of research. Effective workflow management therefore is important for efficient research and transparent and reproducible results. In this hands-on tutorial we will provide an interactive hands-on introduction into managing workflows with pyiron (www.pyiron.org). Pyiron is an integrated development environment for materials science built on python and Jupyter notebooks that may be used for a wide variety of simulation tasks, from rapid prototyping to high performance computing. | ||
|
||
|
||
|
||
```{tableofcontents} | ||
``` |
Oops, something went wrong.