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Binding energy app

This repository holds an app written in python to plot and export binding energy values of atomic elements from Z = 1 - 92. This app considers data from four sources contained in the data/ folder, and they are described below.

experimental

Experimental measurements from solids, compiled by Williams (1995) from references

  1. Bearden and Burr (1967),
  2. Photoemission in Solids I (1978), and
  3. Fuggle and Mårtensson (1980) .

dirac-fock

Results by Desclaux (1973) computed with the Dirac-Fock method.

perturbative

Relativistic values computed with the parametric potential method by M. Klapisch (1971) implemented in the HULLAC code. Some of these results have been published in Mendez et al. (2019).

hartree-fock

Theoretical calculations with the HF86 code by C. Froese Fischer (1987).

IMPORTANT: The app has not been packaged (yet) and it requires dash dash-bootstrap-components, jupyter-dash, periodictable, pandas, numpy, scipy, os, re and nbformat to work. At this point, the user should install them manually (for example, using pip or conda).

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Interactive app with binding energies data

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