Our paper on MuAPBEK, a new density functional for quantum chemistry has been published in the Journal of Chemical Physics (JChemPhys or JCP)
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Check it out: pubs.aip.org/aip/jcp/arti...
pubs.aip.org
MuAPBEK: An improved analytical kinetic energy density functional for quantum chemistry
Orbital-free density functional theory (OFDFT) enables full quantum-mechanical simulations based solely on electron densities but is limited by the lack of accu