arXiv subjects

J. Y. Y. Lin

Publications and source records attributed to J. Y. Y. Lin.

5 recordsLinked to original sources

arXiv2019

Frustrated Magnetism in Mott Insulating (V$_{1-x}$Cr$_x$)$_2$O$_3$

V2O3 famously features all four combinations of paramagnetic vs antiferromagnetic, and metallic vs insulating states of matter in response to %-level doping, pressure in the GPa range, and temperature below 300 K. Using time-of-flight neutron spectroscopy combined with density functional theory calculations of magnetic interactions, we have mapped and analyzed the inelastic magnetic neutron scattering cross section over a wide range of energy and momentum transfer in the chromium stabilized antiferromagnetic and paramagnetic insulating phases (AFI & PI). Our results reveal an important magnetic frustration and degeneracy of the PI phase which is relieved by the rhombohedral to monoclinic transition at $T_N=185$ K due to a significant magneto-elastic coupling. This leads to the recognition that magnetic frustration is an inherent property of the paramagnetic phase in $\rm (V_{1-x}Cr_x)_2O_3$ and plays a key role in suppressing the magnetic long range ordering temperature and exposing a large phase space for the paramagnetic Mott metal-insulator transition to occur.

cond-mat.str-el↗

arXiv2018

A nuclear quantum effect with pure anharmonicity and the anomalous thermal expansion of silicon

Despite the widespread use of silicon in modern technology, its peculiar thermal expansion is not well-understood. Adapting harmonic phonons to the specific volume at temperature, the quasiharmonic approximation, has become accepted for simulating the thermal expansion, but has given ambiguous interpretations for microscopic mechanisms. To test atomistic mechanisms, we performed inelastic neutron scattering experiments from 100-1500K on a single-crystal of silicon to measure the changes in phonon frequencies. Our state-of-the-art ab initio calculations, which fully account for phonon anharmonicity and nuclear quantum effects, reproduced the measured shifts of individual phonons with temperature, whereas quasiharmonic shifts were mostly of the wrong sign. Surprisingly, the accepted quasiharmonic model was found to predict the thermal expansion owing to a fortuitous cancellation of contributions from individual phonons.

cond-mat.mtrl-sci↗

arXiv2016

Momentum and Energy Dependent Resolution Function of the ARCS Neutron Chopper Spectrometer at High Momentum Transfer: Comparing Simulation and Experimen

Inelastic neutron scattering at high momentum transfers (i.e. $Q\ge20$ Å) or DINS provides direct observation of the momentum distribution of light atoms, making it a powerful probe for studying single-particle motions in liquids and solids. The quantitative analysis of DINS data requires an accurate knowledge of the instrument resolution function $R_{i}({Q},E)$ at each $Q$ and energy transfer $E$, where the label $i$ indicates whether the resolution was experimentally observed $i={obs}$ or simulated $i=sim$. Here, we describe two independent methods for determining the total resolution function $R_{i}({Q},E)$ of the ARCS neutron instrument at the Spallation Neutron Source, Oak Ridge National Laboratory. The first method uses experimental data from an archetypical system (liquid $^4$He) studied with DINS, which are then numerically deconvoluted using its previously determined intrinsic scattering function to yield $R_{obs}({Q},E)$. The second approach uses accurate Monte Carlo simulations of the ARCS spectrometer, which account for all instrument contributions, coupled to a representative scattering kernel to reproduce the experimentally observed response $S({Q},E)$. Using a delta function as scattering kernel, the simulation yields a resolution function $R_{sim}({Q},E)$ with comparable lineshape and features as $R_{obs}({Q},E)$, but somewhat narrower due to the ideal nature of the model. Using each of these two $R_{i}({Q},E)$ separately, we extract characteristic parameters of liquid $^4$He such as the intrinsic linewidth $α_2$ (which sets the atomic kinetic energy $\langle K\rangle\simα_2$) in the normal liquid and the Bose-Einstein condensate parameter $n_0$ in the superfluid phase. The extracted $α_2$ values agree well with previous measurements, independently of which $R_i(Q,y)$ is used to analyze the data.

physics.ins-det↗

arXiv2015

Light atom quantum oscillations in UC and US

High energy vibrational scattering in the binary systems UC and US is measured using time-of-flight inelastic neutron scattering. A clear set of well-defined peaks equally separated in energy is observed in UC, corresponding to harmonic oscillations of the light C atoms in a cage of heavy U atoms. The scattering is much weaker in US and only a few oscillator peaks are visible. We show how the difference between the materials can be understood by considering the neutron scattering lengths and masses of the lighter atoms. Monte Carlo ray tracing is used to simulate the scattering, with near quantitative agreement with the data in UC, and some differences with US. The possibility of observing anharmonicity and anisotropy in the potentials of the light atoms is investigated in UC. Overall the observed data is well accounted for by considering each light atom as a single atom isotropic quantum harmonic oscillator.

cond-mat.mtrl-sci↗

arXiv2008

Phonon Density of States of LaFeAsO1-xFx

We have studied the phonon density of states (PDOS) in LaFeAsO1-xFx with inelastic neutron scattering methods. The PDOS of the parent compound(x=0) is very similar to the PDOS of samples optimally doped with fluorine to achieve the maximum Tc (x~0.1). Good agreement is found between the experimental PDOS and first-principle calculations with the exception of a small difference in Fe mode frequencies. The PDOS reported here is not consistent with conventional electron-phonon mediated superconductivity.

cond-mat.supr-con↗