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High-Pressure Ice Structures: Ab Initio Predictions and Search Methods

This study explores seven new ice structures at high pressure using advanced prediction methods. Results published in leading scientific journals, offering insights into ice's behavior under extreme conditions.

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High-Pressure Ice Structures: Ab Initio Predictions and Search Methods

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  1. Ab Initio Structure Search Methods predict Seven New Ice Structures at High Pressure Militzer, Wilson, Phys. Rev. Lett.105, 195701 (2010). Wang et al., Nature Commun., 2, 563 (2011). McMahon, PRB84, 220104(R) (2011). Jiet al., PRB, 84, 220105(R) (2011). Hermann et al., PNAS109, 745 (2011). Zhang, Wilson, Driver, Militzer, PRB 87, 02411 (2013).

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