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QCaml/gaussian_integrals/lib/kinetic.mli
2020-09-26 12:02:53 +02:00

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OCaml

(** Electronic kinetic energy integrals, expressed as a matrix in a {!Basis.t}.
{%
$$
T_{ij} = \left \langle \chi_i \left| -\frac{1}{2} \Delta \right| \chi_j \right \rangle
$$
%}
*)
include module type of Matrix_on_basis