From 470ab395fc74450d6d81a23870889efc5e0eb8cc Mon Sep 17 00:00:00 2001 From: Motohiko Tanaka <111667711+Mtanaka77@users.noreply.github.com> Date: Fri, 4 Oct 2024 18:56:44 +0900 Subject: [PATCH] Update README.md --- README.md | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/README.md b/README.md index 7e6315d..fc0b9a2 100644 --- a/README.md +++ b/README.md @@ -22,7 +22,7 @@ One needs files in the simulation: 1) @cnt3em_3pCa.f03 or @a_cnt3-3p7Ca.f03: Mol 4) p_config_ss.xyz_D150 and P135 of pellet electrons: H, C and Au ions and electrons. The program is written in Fortran 2003/Fortran 2008 (write format in the same line) and MPI of Ver.3 for parallelization. -The description of each subroutine and important lines of @cnt3em_07Aa.f03 and/or @a_cnt3-3p7Ca.f03 and +The description of each subroutine and important lines of @cnt3em_07Ca.f03 and/or @a_cnt3-3p7Ca.f03 and the post-processed program @3ddisppC.f03, etc. (to be shown later), are written with many comments of the simulation code. Initial 100 lines of the file @cnt3em_3pCa.f03 or @a_cnt3-3p7Ca.f03 are devoted to give the title, references, summary of subroutines and remarks of the simulation code. @@ -78,7 +78,7 @@ The script 'mpif90 @a_cnt3-3p7Ca.f03' needs param_em3p7_Ca.h, Cntemp_config.STAR % fftw3-3.3.10: ./configure --disable-shared --enable-maintainer-mode --enable-threads --prefix=/opt/fftw3 - % mpif90 -mcmodel=medium -fPIC @cnt3em3_3pCa.f03 -I/opt/fftw3/include -L/opt/fftw3/lib -lfftw3 + % mpif90 -mcmodel=medium -fPIC @a_cnt3_3p7Ca.f03 -I/opt/fftw3/include -L/opt/fftw3/lib -lfftw3 Two different fortrans, PGI and gfotran, are incompatible with processors of the same name but different styles.