4.8 Article

Quantum simulation of low-temperature metallic liquid hydrogen

期刊

NATURE COMMUNICATIONS
卷 4, 期 -, 页码 -

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NATURE PUBLISHING GROUP
DOI: 10.1038/ncomms3064

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资金

  1. MOST [2013CB934600]
  2. NSFC [11275008, 91021007, 10974238]
  3. European Research Council
  4. Royal Society through a Royal Society Wolfson Research Merit Award
  5. EPSRC
  6. EPSRC [EP/F032773/1, EP/K014560/1, EP/G007489/2, EP/F013612/1, EP/K013564/1, EP/J017639/1, EP/K013688/1] Funding Source: UKRI
  7. Engineering and Physical Sciences Research Council [EP/F032773/1, EP/K014560/1, EP/K013688/1, EP/K013564/1, EP/J017639/1, EP/G007489/2, EP/F013612/1] Funding Source: researchfish

向作者/读者索取更多资源

The melting temperature of solid hydrogen drops with pressure above similar to 65 GPa, suggesting that a liquid state might exist at low temperatures. It has also been suggested that this low-temperature liquid state might be non-molecular and metallic, although evidence for such behaviour is lacking. Here we report results for hydrogen at high pressures using ab initio methods, which include a description of the quantum motion of the protons. We determine the melting temperature as a function of pressure and find an atomic solid phase from 500 to 800 GPa, which melts at <200 K. Beyond this and up to 1,200 GPa, a metallic atomic liquid is stable at temperatures as low as 50 K. The quantum motion of the protons is critical to the low melting temperature reported, as simulations with classical nuclei lead to considerably higher melting temperatures of similar to 300 K across the entire pressure range considered.

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