Computational Quantum Physics: Publications
Read the latest papers published by our researchers.
Results
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Some recent developments in auxiliary-field quantum Monte Carlo for real materials
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Quantum generative model for sampling many-body spectral functions
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Wave functions, electronic localization, and bonding properties for correlated materials beyond the Kohn-Sham formalism
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Nonlinear nanoelectrodynamics of a Weyl metal
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Anti-Poiseuille Flow: Increased Vortex Velocity at Superconductor Edges
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Calculation of Metallocene Ionization Potentials via Auxiliary Field Quantum Monte Carlo: Towards Benchmark Quantum Chemistry for Transition Metals
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Exotic Superfluid Phases in Spin Polarized Systems on Optical Lattices
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Precision Many-Body Study of the Berezinskii-Kosterlitz-Thouless Transition and Temperature-Dependent Properties in the Two-Dimensional Fermi Gas
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Stripes and spin-density waves in the doped two-dimensional Hubbard model: ground state phase diagram
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Correlation-consistent Gaussian basis sets for solids made simple
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Tunable Cr4+ Molecular Color Centers
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Approximating matrix eigenvalues by subspace iteration with repeated random sparsification
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Full-frequency GW without frequency
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Anharmonic Lattice Dynamics from Vibrational Dynamical Mean-Field Theory
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A simplified GW/BSE approach for charged and neutral excitation energies of large molecules and nanomaterials
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Triplet superconductivity from non-local Coulomb repulsion in Sn/Si(111)
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Hierarchy of Ideal Flatbands in Chiral Twisted Multilayer Graphene Models
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Van Hove tuning of AV3Sb5 kagome metals under pressure and strain
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Fractional Quantum Hall States on CP2 Space
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Continuous-variable neural-network quantum states and the quantum rotor model
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Overcoming barriers to scalability in variational quantum Monte Carlo
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The effects of strain in multi-orbital superconductors: the case of Sr
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Thermalization of dilute impurities in one dimensional spin chains
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Markovian baths and quantum avalanches
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Digital quantum simulation of NMR experiments
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Platform tailored co-design of gate-based quantum simulation
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Ab-initio investigation of Er3+ defects in tungsten disulfide
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Simple Exchange-Correlation Energy Functionals for Strongly Coupled Light-Matter Systems based on the Fluctuation-Dissipation Theorem
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Cavity-Modulated Proton Transfer Reactions
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Polaritonic Unitary Coupled Cluster for Quantum Computations
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Linear free energy relationships in electrostatic catalysis
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Robust Pipek–Mezey Orbital Localization in Periodic Solids
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Rotational g factors and Lorentz forces of molecules and solids from density-functional perturbation theory
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Topology invisible to eigenvalues in obstructed atomic insulators
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Gapless electronic topology without free-electron counterpart
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Staggered Pseudo Magnetic Field in Twisted Transition Metal Dichalcogenides: Physical Origin and Experimental Consequences
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Cavity-modified unimolecular dissociation reactions via intramolecular vibrational energy redistribution
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Magic angle conditions for twisted 3D topological insulators
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Shining light on the microscopic resonant mechanism responsible for cavity-mediated chemical reactivity
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Error Rate Reduction of Single-Qubit Gates via Noise-Aware Decomposition
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Ab initio linear-response approach to vibro-polaritons in the cavity Born-Oppenheimer approximation
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Charge self-consistent electronic structure calculations with dynamical mean-field theory using Quantum ESPRESSO, Wannier90 and TRIQS
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Fermionic Wave Functions from Neural-Network Constrained Hidden States
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Tuning the Fermi Liquid Crossover in Sr
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Seebeck coefficient in a cuprate superconductor: particle-hole asymmetry in the strange metal phase and Fermi surface transformation in the pseudogap phase
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Sachdev-Ye-Kitaev Models and Beyond: A Window into Non-Fermi Liquids
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Dynamical mean field theory of moiré bilayer transition metal dichalcogenides: phase diagram, resistivity, and quantum criticality
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Unveiling the underlying interactions in Ta2NiSe5 from photo-induced lifetime change