From 49977e1bcbab57c9becf8869ff7e5af3ca69c964 Mon Sep 17 00:00:00 2001 From: Carlos Murilo Romero Rocha <114645116+Cmurilochem@users.noreply.github.com> Date: Thu, 22 Dec 2022 16:32:27 +0100 Subject: [PATCH] Update README.md --- README.md | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/README.md b/README.md index 6d5a817..97e9790 100644 --- a/README.md +++ b/README.md @@ -6,9 +6,9 @@ For diatomic molecules, the code also allows users obtain experimentally-derived The program performs an automatic global minimum search on the final fitted PES, harmonic vibrational analysis on the global minimum, in addition to provide ready-to-use subroutines containing the fitted n-body terms. These are output as CHIPR_DIAT_FUNC.f90, CHIPR_TRIAT_FUNC.f90 and CHIPR_TETRA_FUNC.f90 for two-body, three-body and four-body terms, respectively. -The source code can be found in "CHIPR-4.0_SOURCE_CODE". Test runs for C2, N2, SiC, C3, SiC2, C3H, and C2H2 are provided as separate directories. +The source code can be found in "CHIPR-4.0_SOURCE_CODE". Test runs for C2, N2, SiC, C3, SiC2, C3H, and C2H2 are provided as separate directories. -see https://data.mendeley.com/datasets/8wdv87gt5x/2 to access the original code and publication. +see https://data.mendeley.com/datasets/8wdv87gt5x/2 to access the original open source version of the code and publication. Authors: Carlos M. R. Rocha* (carlosmurilorocha@gmail.com) and Antonio J. C. Varandas (varandas@uc.pt)