DeepPolaron ML-MD simulations show rutile electrons form Ti-localized polarons hopping along [001] with 39 meV barrier and 4.4e-2 cm2/Vs mobility, while anatase holes form O-localized polarons hopping to second neighbors with 139 meV barrier and 1.4e-3 cm2/Vs mobility.
hub
Cauchy and the gradient method , volume=
5 Pith papers cite this work, alongside 3,227 external citations. Polarity classification is still indexing.
5
Pith papers citing it
3,227
external citations · OpenAlex
hub tools
citation-role summary
background 1
method 1
citation-polarity summary
verdicts
UNVERDICTED 5representative citing papers
Skala is a neural XC functional trained on wavefunction data that beats state-of-the-art hybrids on main-group chemistry benchmarks at semi-local computational cost.
QFlow-SD matches canonical UCCSD energies for tested molecules while using substantially fewer qubits via reduced active spaces and constant-depth circuits, with a composite classical-quantum downfolding strategy demonstrated for water.
Combines Operator Fourier Transform with low-rank Cross-DEIM to accelerate 2D Helmholtz equation solutions via pseudo-time Schrödinger integrals.
The paper provides an expository review of squeezed states of light and related phenomena using the Wigner phase-space formalism and groups such as Lorentz and symplectic.
citing papers explorer
-
Quantum Flow algorithm: quantum simulations of chemical systems using reduced quantum resources and constant depth quantum circuits
QFlow-SD matches canonical UCCSD energies for tested molecules while using substantially fewer qubits via reduced active spaces and constant-depth circuits, with a composite classical-quantum downfolding strategy demonstrated for water.