diff --git a/doc/gpumd/input_parameters/compute.rst b/doc/gpumd/input_parameters/compute.rst index 54ae0955..2e5b13fc 100644 --- a/doc/gpumd/input_parameters/compute.rst +++ b/doc/gpumd/input_parameters/compute.rst @@ -23,15 +23,15 @@ The second parameter :attr:`sample_interval` means sampling the quantities every The third parameter :attr:`output_interval` means averaging over so many sampled data before giving one output. Starting from the fourth parameter, one can list the quantities to be computed. - -The allowed names for the quantities are: - -* :attr:`temperature`, which is the temperature -* :attr:`potential`, which is the potential energy -* :attr:`force`, which is the force vector -* :attr:`virial`, which is the diagonal part of the virial -* :attr:`jp`, which is the potential part of the heat current vector -* :attr:`jk`, which is the kinetic part of the heat current vector +The allowed names for :attr:`quantity` are: + +* :attr:`temperature`, which yields the temperature +* :attr:`potential`, which yields the potential energy +* :attr:`force`, which yields the force vector +* :attr:`virial`, which yields the diagonal part of the virial +* :attr:`jp`, which yields the potential part of the heat current vector +* :attr:`jk`, which yields the kinetic part of the heat current vector +* :attr:`momentum`, which yields the momentum One can write one or more (distinct) names in any order.