In general, techniques are described for providing diversity in simulation datasets during modeling. A device comprising a memory and a processor may be configured to perform the techniques. The memory may store simulation configuration files for conducting simulations of the network device within a test environment. The processor may conduct, based on the simulation configuration files, each of the simulations with respect to the network device to collect corresponding simulation datasets indicative of an operating state of the network device. The processor may determine a level of similarity between the simulation datasets, and select, responsive to a comparison of the level of similarity to a diversity threshold, a subset of the simulation datasets. The processor may generate, based on the selected subset of the simulation datasets, a model representative of the network device that predicts, responsive to configuration parameters for the network device, an operating state of the network device.