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. 2019 Jan 4;116(4):1110–1115. doi: 10.1073/pnas.1815117116

Fig. 2.

Fig. 2.

Oxygen–oxygen, oxygen–hydrogen, and hydrogen–hydrogen RDFs at 300 K and experimental density computed via (PI)MD simulations in the constant number of particles, volume, and temperature (NVT) ensemble using the NN potential. The experimental O–O RDF was obtained from ref. 37, and the experimental O–H and H–H RDFs were taken from refs. 38 and 39.