@article {2023|2165,
	title = {Unwrapping NPT Simulations to Calculate Diffusion Coefficients},
	journal = {Journal of Chemical Theory and Computation},
	volume = {19},
	year = {2023},
	pages = {3406{\textendash}3417},
	doi = {10.1021/acs.jctc.3c00308},
	url = {https://doi.org/10.1021/acs.jctc.3c00308},
	author = {Jakob T{\'o}mas Bullerjahn and S{\"o}ren von B{\"u}low and Maziar Heidari and J{\'e}r{\^o}me H{\'e}nin and Gerhard Hummer}
}
