Closed DaehoHan closed 1 year ago
The previous implementation gives weird PESs, since H at x=-Z is undefined.
def compute_model(q, params, full_id): model = params["model"] res = Subotnik.double_arch_geometry(q, params, full_id) return res model_params = {"model":3, "model0":3, "nstates":2} plot_params.update( { "xlim":[-15.0, 15.0], "ylim":[-0.4, 0.4], "ylim2":[-0.4, 0.4], "show_nac_abs":1 }) dynamics_plotting.plot_surfaces(compute_model, [ model_params ], [0, 1], -15.0, 15.0, 0.05, plot_params)
The previous implementation gives weird PESs, since H at x=-Z is undefined.