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QM/MM simulation of liquid water with an adaptive quantum region |
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| Authors: | Bernstein Noam Várnai Csilla Solt Iván Winfield Steven A Payne Mike C Simon István Fuxreiter Mónika Csányi Gábor |
| Institution: | Center for Computational Materials Science, Naval Research Laboratory, Washington, DC 20375, USA. noam.bernstein@nrl.navy.mil |
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