f(t) gravity 2teleparallel gravity 2anisotropic cosmology 1charged black holes 1electromagnetic fields 1kantowski-sachs cosmology 1reconstruction methods 1static spherically symmetric solutions 1wormholes 1
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physics.chem-ph2026
Consistent GMTKN55 and molecular-crystal accuracy using minimally empirical DFT with XDM(Z) dispersion
Kyle R. Bryenton, Erin R. Johnson
Density-functional theory (DFT) has become the workhorse of modern computational chemistry, with dispersion corrections such as the exchange-hole dipole moment (XDM) model playing…
physics.chem-ph2026
Unifying Decoherence and Phase Evolution in Mixed Quantum-Classical Dynamics through Exact Factorization
Jong-Kwon Ha, Seong Ho Kim, Seung Kyu Min
We propose mixed quantum-classical equations of motion that unify electronic coherence and phase evolution simultaneously within the exact factorization framework. Our derivation s…
physics.chem-ph2025★ 2 cited
WTMAD-4: A Fair Weighting Scheme for GMTKN55
Kyle R. Bryenton, Erin R. Johnson
The GMTKN55 data set is a collection of standard benchmarks used in molecular quantum chemistry that spans small- and large-molecule thermochemistry, reaction barriers, and non-cov…