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We have performed ab-initio lattice dynamics and molecular dynamics studies of Li2X (X=O, S and Se) to understand the ionic conduction in these compounds. The inelastic neutron scattering measurements on Li2O have been performed across its…

材料科学 · 物理学 2019-06-19 M. K. Gupta , Baltej Singh , Prabhatasree Goel , R. Mittal , S. Rols , S. L. Chaplot

The deposition of one silicon monolayer on the silver (111) substrate in the temperature range 150-300$^\circ$C, gives rise to a mix of (4$\times$4), ($2\sqrt{3}\times 2\sqrt{3}$)R30$^\circ$ and ($\sqrt{13}\times\sqrt{13}$)R13.9$^\circ$…

材料科学 · 物理学 2015-06-04 H. Jamgotchian , Y. Colignon , N. Hamzaoui , B. Ealet , J. Y. Hoarau , B. Aufray , J. P. Bibérian

As it is known from visible light experiments, silicon under femtosecond pulse irradiation can undergo the so-called 'nonthermal melting' if the density of electrons excited from the valence to the conduction band overcomes a certain…

材料科学 · 物理学 2015-04-21 Nikita Medvedev , Zheng Li , Beata Ziaja

With the advances in miniaturization, understanding and controlling properties of significant technological systems like silicon in nano regime assumes considerable importance. It turns out that small silicon clusters in the size range of…

介观与纳米尺度物理 · 物理学 2009-11-11 Shahab Zorriasatein , Kavita Joshi , D. G. Kanhere

Aerosols have been found to be nearly ubiquitous in substellar atmospheres. The precise temperature at which these aerosols begin to form in exoplanets has yet to be observationally constrained. Theoretical models and observations of muted…

We report high-resolution neutron powder diffraction on Sr0.61Ba0.39Nb2O6, SBN61, in the temperature range 15-500 K. The results indicate that the low-temperature anomalies (T<100K) observed in the dielectric dispersion are due to small…

材料科学 · 物理学 2007-05-23 J. Schefer , D. Schaniel , V. Pomjakushin , U. Stuhr , V. Petricek , Th. Woike , M. Wohlecke , M. Imlau

We describe the generation and properties of a cryogenic beam of $^7$Li$_2$ dimers from sublimation of a neon matrix where lithium atoms have been implanted via laser ablation of solid precursors of metallic lithium or lithium hydride…

We present a parametric study of the diffuse magnetic scattering at (1/2,1/2,1/2) positions in reciprocal space, ascribed to a frozen antiferromagnetic spin ice state in single crystalline Tb2Ti2O7. Our high-resolution neutron scattering…

The large $\Delta$C observed at 17.5 K in URu$_{2}$Si$_{2}$ is inconsistent with the small, 0.04 $\mu_{B}$ moment measured for the antiferromagnetism observed starting (perhaps coincidentally) at the same temperature. We report measurements…

强关联电子 · 物理学 2009-11-10 J. S. Kim , D. Hall , P. Kumar , G. R. Stewart

The controversy regarding the precise nature of the high-temperature phase of 1T-TiSe2 lasts for decades. It has intensified in recent times when new evidence for the excitonic origin of the low-temperature charge-density wave state started…

We present the results of a large scale molecular dynamics computer simulation in which we investigated the static and dynamic properties of a silica melt in the temperature range in which the viscosity of the system changes from O(10^-2)…

统计力学 · 物理学 2009-10-31 Jurgen Horbach , Walter Kob

The radiation chemistry and physics of solid N2O have been increasingly studied due to its potential presence on the surfaces of cold, outer Solar System bodies. However, to date, no study has investigated systematically the influence of…

We simultaneously analyze the spectral line energy distributions (SLEDs) of CO and H2 of six local luminous infrared (IR) Seyfert galaxies. For the CO SLEDs, we used new Herschel/SPIRE FTS data (from J=4-3 to J=13-12) and ground-based…

星系天体物理 · 物理学 2014-07-02 Miguel Pereira-Santaella , Luigi Spinoglio , Paul P. van der Werf , Javier Piqueras López

We have investigated Na2SiO5 melts with inelastic neutron scattering at temperatures up to 1600K. The Si-O network relaxes on a time scale of ns, whereas the Na ion relaxation dynamics are found on a time scale of 10ps. The elastic…

材料科学 · 物理学 2007-05-23 A. Meyer , H. Schober , D. B. Dingwell

The properties of amorphous solid water at and near the calorimetric glass transition temperature, $T_{g}$, of 136 K have been debated for years. One hypothesis is that water turns into a "true" liquid at $T_{g}$ (i.e., it becomes ergodic)…

软凝聚态物质 · 物理学 2025-03-03 Greg A. Kimmel , Megan K. Dunlap , Kirill Gurdumov , R. Scott Smith , Loni Kringle , Bruce D. Kay

The melting curve of pure silica (SiO$_2$) was determined using {\it ab initio} density functional theory together with the solid-liquid coexisting approach, thermodynamic integration and the Z method. The melting curves are consistent with…

材料科学 · 物理学 2024-01-19 Ming Geng , Chris E. Mohn

We investigated the temperature dependence of the superlattice intensity and thermal diffuse scattering intensity of BaAl2O4, which has a network structure with corner-sharing AlO4 tetrahedra, via synchrotron X-ray diffraction experiments.…

材料科学 · 物理学 2016-04-27 Y. Ishii , S. Mori , Y. Nakahira , C. Moriyoshi , H. Taniguchi , H. Moriwake , Y. Kuroiwa

The glass transition of supercooled fluids is a particular challenge for computer simulation, because the (longest) relaxation times increase by about 15 decades upon approaching the transition temperature T_g. Brute-force molecular…

统计力学 · 物理学 2007-05-23 Kurt Binder , Jörg Baschnagel , Walter Kob , Wolfgang Paul

Synchrotron X-ray diffraction patterns were measured and analyzed for a polycrystalline sample of the room-temperature ferromagnet Sr3.12Er0.88Co4O10.5 from 300 to 650 K, from which two structural phase transitions were found to occur…

强关联电子 · 物理学 2009-11-13 Shintaro Ishiwata , Wataru Kobayashi , Ichiro Terasaki , Kenichi Kato , Masaki Takata

We studied in detail the low temperature/high magnetic field phases of URu$_{2}$Si$_{2}$ single crystals with specific heat, magnetocaloric effect, and magnetoresistance in magnetic fields up to 45 T. Data obtained down to 0.5 K, and…

强关联电子 · 物理学 2009-11-07 M. Jaime , K. H. Kim , G. Jorge , S. McCall , J. A Mydosh