From ed6396001ac49ad24af1d1db6e2ebe893ddefc80 Mon Sep 17 00:00:00 2001 From: Easy Build <easybuild@login4.head.smc.salomon.it4i.cz> Date: Thu, 14 Feb 2019 08:15:04 +0100 Subject: [PATCH] Thu, 14 Feb 2019 08:15:04 +0100 --- uv2000.csv | 1 + uv2000.md | 1 + 2 files changed, 2 insertions(+) diff --git a/uv2000.csv b/uv2000.csv index 7bc20fa5..8c820abd 100644 --- a/uv2000.csv +++ b/uv2000.csv @@ -47,5 +47,6 @@ ScaLAPACK/2.0.2-gompi-2017a-OpenBLAS-0.2.19-LAPACK-3.7.0,4 SQLite/3.17.0,4 Tcl/8.6.6,4 util-linux/2.32,4 +VASP/5.4.4-intel-2017c-mkl=cluster,4 VDE2/2.3.2,4 zlib/1.2.11,4 diff --git a/uv2000.md b/uv2000.md index c576611e..b7e03ebb 100644 --- a/uv2000.md +++ b/uv2000.md @@ -59,6 +59,7 @@ | Module | Description | | ------ | ----------- | +| [VASP](http://www.vasp.at) | The Vienna Ab initio Simulation Package (VASP) is a computer program for atomic scale materials modelling, e.g. electronic structure calculations and quantum-mechanical molecular dynamics, from first principles. To use VASP, You need academic licenses from University of Wiena. Follow the instructions https://www.vasp.at/index.php/faqs. Then send us please a list of authorized users and their ID for which you need this access. Please use only http://support.it4i.cz/rt. We are responsible to verify your licenses. After succesfull verification You will be granted to use VASP in our enviroment. | ## System -- GitLab