mirror of
https://github.com/LCPQ/QUESTDB_website.git
synced 2024-11-04 13:13:55 +01:00
16 lines
790 B
Markdown
16 lines
790 B
Markdown
---
|
||
title: "Welcome"
|
||
date: 2019-08-29 09:00
|
||
draft: false
|
||
---
|
||
|
||
The QUEST project purpose to provide reference excitation energies in order to compare the precision of quantum chemistry methods by statistical calculations. This website is an integral part of this project and makes it possible to dynamically do statistical calculations to determine the best methods for a series of molecules. you can find references for the datasets in the [publication section](publications)
|
||
|
||
The statistics are showing as data table and as a graph (using the [Plotly JavaScript Open Source Graphing Library](https://plotly.com/javascript))
|
||
|
||
## Example of charts
|
||
{{< figure src="/img/samplelot.png" title="Statistical results for QUEST#1 set in the aug‑cc‑pVTZ basis for all single excitations" >}}
|
||
|
||
|
||
|