In this paper, longitudinal train dynamics and coupler forces were modelled based on experimental results of Research Design and Standard Organisation and from the available literature. The model was solved numerically in MATLAB. Moreover, a multibody model was developed in Universal Mechanism software considering a locomotive and two coaches that were validated with the mathematical model by comparing acceleration responses of locomotives and coaches running at 150 km/h and then applying emergency braking. The validated model in the Universal Mechanism software was extended and used for additional study. For the case study, the Rajdhani Express train was considered running at its maximum operational speed of 160 km/h with track gradient of New Delhi and Agra Cantt station. The performance of the rail vehicle in five braking phases was evaluated. The maximum compression force in coupler increased after the application of each brake phase. Moreover, the maximum compressive coupler force of 149 t was experienced at the third quarter of the train. However, the ride quality and comfort were within the satisfactory range prescribed by Research Design and Standard Organisation.