From 9941d9132ce1cf9f30f4f169f6ebe8595c7be0c5 Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Wed, 4 Jun 2025 00:30:10 -0400 Subject: [PATCH] reformulate --- doc/src/molecule.rst | 8 ++++---- 1 file changed, 4 insertions(+), 4 deletions(-) diff --git a/doc/src/molecule.rst b/doc/src/molecule.rst index 2453a4a9f0..5e7973f2ca 100644 --- a/doc/src/molecule.rst +++ b/doc/src/molecule.rst @@ -682,13 +682,13 @@ The format of a JSON format individual molecule file must follow the `JSON format `_, which evolved from the JavaScript programming language as a programming-language-neutral data interchange language. The JSON syntax is independent of its content, -and thus the data in the file must follow suitable conventions to be +and thus the data in the file must follow suitable conventions to be correctly parsed during input. LAMMPS provides a `JSON schema file `_ to define those conventions so that files can be validated against the requirements. Validating a particular -molecule file against this schema ensures that the syntax and -conventions are followed, but it does **not** check whether the file -contents are physically meaningful. +molecule file against this schema ensures that both, the syntax *and* +the conventions are followed, but it **cannot** check whether the +file contents are physically meaningful. Here is a simple example for the same TIP3P water molecule from above in JSON format and also using :doc:`type lables ` instead of