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ORCID"Increasing the time step with mass scaling in Born-Oppenheimer ab ..."
Han Zheng, Shenglong Wang, Yingkai Zhang (2009)
- Han Zheng, Shenglong Wang, Yingkai Zhang:
Increasing the time step with mass scaling in Born-Oppenheimer ab initio QM/MM molecular dynamics simulations. J. Comput. Chem. 30(16): 2706-2711 (2009)
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