From 78fd4e22c147f2d52637253f8116921768b9c026 Mon Sep 17 00:00:00 2001 From: LiangWenshuo1118 <73432685+LiangWenshuo1118@users.noreply.github.com> Date: Tue, 6 Dec 2022 13:59:21 +0800 Subject: [PATCH] Update README.md add 'abacus/stru' format key Signed-off-by: LiangWenshuo1118 <73432685+LiangWenshuo1118@users.noreply.github.com> --- README.md | 1 + 1 file changed, 1 insertion(+) diff --git a/README.md b/README.md index 02a955beb..32f778311 100644 --- a/README.md +++ b/README.md @@ -80,6 +80,7 @@ The `System` or `LabeledSystem` can be constructed from the following file forma | Amber | multi | True | True | LabeledSystem | 'amber/md' | | Amber/sqm | sqm.out | False | False | System | 'sqm/out' | | Gromacs | gro | True | False | System | 'gromacs/gro' | +| ABACUS | STRU | False | False | System | 'abacus/stru' | | ABACUS | STRU | False | True | LabeledSystem | 'abacus/scf' | | ABACUS | cif | True | True | LabeledSystem | 'abacus/md' | | ABACUS | STRU | True | True | LabeledSystem | 'abacus/relax' |