From afa7bdffd36dee5f58b6f658004a3bac3567aabc Mon Sep 17 00:00:00 2001 From: Sebastian Ehlert <28669218+awvwgk@users.noreply.github.com> Date: Thu, 10 Jun 2021 11:51:36 +0200 Subject: [PATCH] Fix gridfile keyword (#489) --- man/xcontrol.7.adoc | 2 +- src/set_module.f90 | 2 +- 2 files changed, 2 insertions(+), 2 deletions(-) diff --git a/man/xcontrol.7.adoc b/man/xcontrol.7.adoc index 8d74a9e5b..65c182783 100644 --- a/man/xcontrol.7.adoc +++ b/man/xcontrol.7.adoc @@ -520,7 +520,7 @@ $write *esp*='bool':: calculate and print electrostatic potential, this will create a data file and a cosmo file -*grid file*='file':: +*gridfile*='file':: read gridpoints for ESP calculation from 'file'. *mos*='bool':: print molden file diff --git a/src/set_module.f90 b/src/set_module.f90 index 035b64f8c..a518f9f58 100644 --- a/src/set_module.f90 +++ b/src/set_module.f90 @@ -1178,7 +1178,7 @@ subroutine set_write(env,key,val) case('orbital energies') if (getValue(env,val,ldum).and.set12) pr_eig = ldum set12 = .false. - case('gridfile') + case('gridfile', 'grid file') if (set13) esp_gridfile = val set13 = .false. case('stm')