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Hydrogen exhibits unusual behaviors at megabar pressures, with consequences for planetary science, condensed matter physics and materials science. Experiments at such extreme conditions are challenging, often resulting in hard-to-interpret…

Materials Science · Physics 2022-01-05 Bingqing Cheng , Guglielmo Mazzola , Michele Ceriotti

Path integral Monte Carlo simulations have been used to study deuterium at high pressure and temperature. The equation of state has been derived in the temperature and density region of 10000 < T < 1000000 K and 0.6 < rho < 2.5 gcm-3. A…

Statistical Mechanics · Physics 2017-03-22 Burkhard Militzer

Solid hydrogen sulfide is well known as a typical molecular crystal but its stability under pressure is still under debate. Particularly, Eremets et al. found the high pressure superconductivity with $T_{c}\approx$ 190 K in a H$_{2}$S…

Superconductivity · Physics 2015-05-20 Defang Duan , Xiaoli Huang , Fubo Tian , Da Li , Hongyu , Yu , Yunxian Liu , Yanbin Ma , Bingbing Liu , Tian Cui

The phase diagram of Zn has been explored up to 140 GPa and 6000 K, by combining optical observations, x-ray diffraction, and ab-initio calculations. In the pressure range covered by this study, Zn is found to retain a hexagonal…

The thermal stability and melting behavior of ultrathin titanium nanowires with multi-shell cylindrical structures are studied using molecular dynamic simulation. The melting temperatures of titanium nanowires show remarkable dependence on…

Materials Science · Physics 2009-11-07 Baolin Wang , Guanghou Wang , Jijun Zhao

Superconductivity in the recently proposed ground-state structures of atomic metallic hydrogen is investigated over the pressure range 500 GPa to 3.5 TPa. Near molecular dissociation, the electron--phonon coupling $\lambda$ and renormalized…

Superconductivity · Physics 2015-05-28 Jeffrey M. McMahon , David M. Ceperley

The superconducting and structural properties of elemental strontium metal were investigated under pressures up to 60 GPa while maintaining cryogenic conditions during pressure application. Applying pressure at low temperatures reveals…

High pressures allow the synthesis of new metastable compounds that remain intact for a sufficiently long time at normal conditions. Until now, it has not been fully understood how pressure, glass-forming ability and solidification of…

Materials Science · Physics 2022-11-08 S. G. Menshikova , N. M. Chtchelkatchev , V. V. Brazhkin

We investigated the effects of uniaxial stress on the pressure-induced alpha-to-omega transition in pure titanium (Ti) by means of angle dispersive x-ray diffraction in a diamond-anvil cell. Experiments under four different pressure…

Materials Science · Physics 2009-11-10 Daniel Errandonea , Y. Meng , M. Somayazulu , D. Hausermann

The principal Hugoniot of carbon, initially diamond, was measured from 3 to 80 TPa (30 to 800 million atmospheres), the highest pressure ever achieved, using radiography of spherically-converging shocks. The shocks were generated by…

The high pressure and high temperature phase diagram of Ta has been studied in a laser-heated diamond-anvil cell (DAC) using x-ray diffraction measurements up to 52 GPa and 3800 K. The melting was observed at nine different pressures, being…

Materials Science · Physics 2009-11-10 D. Errandonea , M. Somayazulu , D. Hausermann , H. K. Mao

The high-pressure dynamics of a computer-modeled silica melt is studied in the framework of the mode-coupling theory of the glass transition (MCT) using static-structure input from molecular-dynamics (MD) computer simulation. The theory…

Materials Science · Physics 2009-11-13 Th. Voigtmann , J. Horbach

High pressure behaviour of liquid GeO2 is investigated by means of molecular dynamics simulations in the pressure range 0-20 GPa and at various temperatures. In agreement with the recent experiments (PRL, 92, 155506, 2004), Ge-O…

Materials Science · Physics 2010-10-19 K. V. Shanavas , Nandini Garg , Surinder M. Sharma

We generate an atomic beam of titanium (Ti) using a "Ti-ball" Ti-sublimation pump, which is a common getter pump used in ultrahigh vacuum (UHV) systems. We show that the sublimated atomic beam can be optically pumped into the metastable…

Atomic Physics · Physics 2025-01-09 Jackson Schrott , Diego Novoa , Scott Eustice , Dan Stamper-Kurn

We report a combined experimental and theoretical study of the melting curve and the structural behavior of vanadium under extreme pressure and temperature. We performed powder x-ray diffraction experiments up to 120 GPa and 4000 K,…

Materials Science · Physics 2019-10-02 D. Errandonea , S. G. MacLeod , L. Burakovsky , D. Santamaria-Perez , J. E. Proctor , H. Cynn , M. Mezouar

The behavior of metals at high pressure is of great importance to the fields of shock physics, geophysics, astrophysics, and nuclear materials. In order to further understand the properties of metals at high pressures we studied the…

Materials Science · Physics 2009-11-13 Michael J. Tambe , Nicola Bonini , Nicola Marzari

Relaxation dynamics, as a key to understand glass formation and glassy properties, remains an elusive and challenging issue in condensed matter physics. In this work, in situ high-pressure synchrotron high-energy x-ray photon correlation…

An ab initio molecular dynamics study of femtosecond laser processing of germanium is presented in this paper. The method based on the finite temperature density functional theory is adopted to probe the structural change, thermal motion of…

Computational Physics · Physics 2016-02-02 Pengfei Ji , Yuwen Zhang

Shock compression of silicon (Si) under extremely high pressures (>100 Mbar) was investigated by using two first-principles methods of orbital-free molecular dynamics (OFMD) and path integral Monte Carlo (PIMC). While pressures from the two…

Materials Science · Physics 2016-12-21 S. X. Hu , B. Militzer , L. A. Collins , K. P. Driver , J. D. Kress

Hydrogen at high temperature and pressure undergoes a phase transition from a liquid molecular phase to a conductive atomic state, or liquid metallic hydrogen, sometimes referred to as the plasma phase transition (PPT). The PPT phase line…

Materials Science · Physics 2019-10-30 Matthew Houtput , Jacques Tempere , Isaac F. Silvera