Mambretti, F., Raucci, U., Gómez-Cápiro, O., Hojamberdiev, M., Berendts, S., Ruland, H., Lerch, M., Parrinello, M. (2026). Theory meets experiment in ammonia decomposition on Li14Cr2N8O: From order to disorder under reaction conditions. The Journal of Chemical Physics. https://doi.org/10.1063/5.0300183