From fe1b69d86015094991a6b80fef9d4277b2f61581 Mon Sep 17 00:00:00 2001 From: Pierre-Francois Loos Date: Tue, 19 Mar 2019 11:39:55 +0100 Subject: [PATCH] Update README.md --- README.md | 10 ++++++---- 1 file changed, 6 insertions(+), 4 deletions(-) diff --git a/README.md b/README.md index 28ea895..11a378b 100644 --- a/README.md +++ b/README.md @@ -1,4 +1,6 @@ -# quack -quack is a small quantum chemistry package which does some weird stuff. -In particular, quack can performed various types of GW calculations (G0W0, evGW, qsGW, etc). -quack also include a very slow integral package called IntPak which does compute many types of different integrals. +# QuAcK +QuAcK is a small quantum chemistry package which does some weird stuff. +In particular, quack can performed +i) various types of GW calculations (G0W0, evGW, qsGW, etc). +ii) ensemble DFT calculations (under progress) +QuAcK also include a very slow integral package called IntPak which does compute many types of different integrals.