From 250b29a7bdf89bf0db06015bdc78e48ad8880180 Mon Sep 17 00:00:00 2001 From: q-posev Date: Tue, 19 Oct 2021 13:31:48 +0200 Subject: [PATCH] fix typo in the example --- trex.org | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/trex.org b/trex.org index f44b008..1841692 100644 --- a/trex.org +++ b/trex.org @@ -197,7 +197,7 @@ H-ccECP GEN 0 1 num = 8 # lmax+1 per atom -max_ang_mom_plus_1 = [ 2, 2 ] +max_ang_mom_plus_1 = [ 1, 1 ] # number of core electrons to remove per atom zcore = [ 0, 0 ]