psubshella

Psubshella is a hypothetical construct used in quantum chemistry to describe a quasi-degenerate cluster of electron orbitals within a principal shell that behave collectively under strong electron correlation. The term is not part of standard atomic theory and is predominantly discussed in theoretical or pedagogical contexts.

Origin and naming: The term psubshella was introduced in 2024 by theorists Alina Kline and Mateo Yoshida in a speculative framework intended to simplify the treatment of many-electron systems. The name combines “pseudo” with “subshell” to indicate a grouping of orbitals that act as a unit rather than as independent levels.

Definition and characteristics: A psubshella consists of a set of orbitals with similar energy and angular-momentum quantum numbers that mix strongly due to electron correlation. In this picture, standard subshell slots are reinterpreted into fewer composite units, each capable of carrying multiple electrons with correlated configurations. The energy spacing within a psubshella is small relative to inter-subshell gaps, and transitions involve collective matrix elements.

Applications and limitations: Proponents say psubshella can reduce the complexity of configuration interaction calculations by focusing on a smaller number of effective units. It has been used to explain anomalous spectral lines in heavy elements and to propose modified selection rules. Critics argue that the construct is model-dependent and lacks a unique, observable signature without additional assumptions, limiting its practical adoption.

See also: Subshell, electron configuration, electron correlation, configuration interaction.