6 papers
Quantum algorithm for simulating resonant inelastic X-ray scattering in battery materials
Ignacio Loaiza, Alexander Kunitsa, Stepan Fomichev +9
Resonant inelastic X-ray scattering (RIXS) is the workhorse experimental technique for probing the structural degradation of higher-capacity cathode materials. However, the interpr…
Quantum algorithms to detect ODMR-active defects for quantum sensing applications
Pablo A. M. Casares, Yanbing Zhou, Utkarsh Azad +6
Spin defects in two-dimensional materials are a promising platform for quantum sensing. Simulating the defect's optical response and optically detected magnetic resonance (ODMR) co…
Nonlinear Spectroscopy via Generalized Quantum Phase Estimation
Ignacio Loaiza, Danial Motlagh, Kasra Hejazi +3
Response theory has a successful history of connecting experimental observations with theoretical predictions. Of particular interest is the optical response of matter, from which…
Simulating near-infrared spectroscopy on a quantum computer for enhanced chemical detection
Ignacio Loaiza, Stepan Fomichev, Danial Motlagh +5
Near-infrared (NIR) spectroscopy is a non-invasive, low-cost, reagent-less, and rapid technique to measure chemical concentrations in a wide variety of sample types. However, extra…
Simulating optically-active spin defects with a quantum computer
Jack S. Baker, Pablo A. M. Casares, Modjtaba Shokrian Zini +5
There is a pressing need for more accurate computational simulations of the opto-electronic properties of defects in materials to aid in the development of quantum sensing platform…
Simulating X-ray absorption spectroscopy of battery materials on a quantum computer
Stepan Fomichev, Kasra Hejazi, Ignacio Loaiza +5
X-ray absorption spectroscopy is a crucial experimental technique for elucidating the mechanisms of structural degradation in battery materials. However, extracting information fro…