The melting temperature of solid hydrogen drops with pressure above ~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 temperatu...
Funder: Max-Planck-Gesellschaft (Max Planck Society); doi: https://doi.org/10.13039/501100004189Fund...
The aim of this Ph.D. thesis is the study of high pressure hydrogen phases, by means of Monte Carlo ...
We survey the phase diagram of high-pressure molecular hydrogen with path integral molecular dynamic...
The melting temperature of solid hydrogen drops with pressure above similar to 65 GPa, suggesting th...
The study of the high pressure phase diagram of hydrogen has continued with renewed effort for about...
Experiments and computer simulations have shown that the melting temperature of solid hydrogen drops...
The study of the high pressure phase diagram of hydrogen has continued with renewed effort for about...
El pdf es la versión pre-print: arXiv:1303.2178Hydrogen is the most abundant element in the universe...
Establishing the phase diagram of hydrogen is a major challenge for experimental and theoretical phy...
Establishing the phase diagram of hydrogen is a major challenge for experimental and theoretical phy...
Variational and Diffusion Monte Carlo are powerful computational methods which can afford accurate e...
Variational and Diffusion Monte Carlo are powerful computational methods which can afford accurate e...
Hydrogen is the simplest molecule in nature. One of the key problems and challenges in condensed mat...
We perform molecular dynamics simulations driven by accurate quantum Monte Carlo forces on dense liq...
We present an accurate computational study of the electronic structure and lattice dynamics of solid...
Funder: Max-Planck-Gesellschaft (Max Planck Society); doi: https://doi.org/10.13039/501100004189Fund...
The aim of this Ph.D. thesis is the study of high pressure hydrogen phases, by means of Monte Carlo ...
We survey the phase diagram of high-pressure molecular hydrogen with path integral molecular dynamic...
The melting temperature of solid hydrogen drops with pressure above similar to 65 GPa, suggesting th...
The study of the high pressure phase diagram of hydrogen has continued with renewed effort for about...
Experiments and computer simulations have shown that the melting temperature of solid hydrogen drops...
The study of the high pressure phase diagram of hydrogen has continued with renewed effort for about...
El pdf es la versión pre-print: arXiv:1303.2178Hydrogen is the most abundant element in the universe...
Establishing the phase diagram of hydrogen is a major challenge for experimental and theoretical phy...
Establishing the phase diagram of hydrogen is a major challenge for experimental and theoretical phy...
Variational and Diffusion Monte Carlo are powerful computational methods which can afford accurate e...
Variational and Diffusion Monte Carlo are powerful computational methods which can afford accurate e...
Hydrogen is the simplest molecule in nature. One of the key problems and challenges in condensed mat...
We perform molecular dynamics simulations driven by accurate quantum Monte Carlo forces on dense liq...
We present an accurate computational study of the electronic structure and lattice dynamics of solid...
Funder: Max-Planck-Gesellschaft (Max Planck Society); doi: https://doi.org/10.13039/501100004189Fund...
The aim of this Ph.D. thesis is the study of high pressure hydrogen phases, by means of Monte Carlo ...
We survey the phase diagram of high-pressure molecular hydrogen with path integral molecular dynamic...