Breach
发表于 2025-3-28 18:38:06
Reminder of the Meta-Narrativesdensity and it incorporates the effect of all the electrons and nuclei. The complexity of the initial problem is hidden in the exchange-correlation part of the potential. Solving the single-electron equations self-consistently, one obtains the equilibrium electron density and the total energy of the
CESS
发表于 2025-3-28 20:46:56
German Angst: After the Honeymoonotential spheres, the ASA brings a real improvement to the MT approximation. However, most of the conventional methods based on the ASA potential use a similar approximation for the Schrödinger and Poisson equations . Therefore, with these methods, reasonably accurate results could only be obtai