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Add tabulated K-edge values

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rasmusvt 2022-06-29 15:26:51 +02:00
parent 6bbd6776b8
commit faf41db41f
1 changed files with 6 additions and 3 deletions
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9
nafuma/xanes/edges.py
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@ -6,7 +6,7 @@ from scipy.constants import c, h
keV_per_J = (1 / 1.602176634e-19) / 1000
# kXu values taken from International Tables for Crystallography Volume , Kulwer Academic Publishers - Dordrect / Boston / London (1992)
k_edge = { 'Z': [ 1, 2,
K = { 'Z': [ 1, 2,
3, 4, 5, 6, 7, 8, 9, 10,
11, 12, 13, 14, 15, 16, 17, 18,
19, 20, 21, 22, 23, 24, 25, 26, 27, 28, 29, 30, 31, 32, 33, 34, 35, 36,
@ -23,5 +23,8 @@ k_edge = { 'Z': [ 1, 2,
0.81549, 0.76969, 0.72762, 0.68877, 0.65291, 0.61977, 0.5891, 0.56047, 0.53378, 0.50915, 0.48582, 0.46409]}
k_edge = pd.DataFrame(k_edge)
k_edge['keV'] = np.round(h*c/(k_edge['kXu']*10**-10) * keV_per_J, 3)
K = pd.DataFrame(K)
K['keV'] = np.round(h*c/(K['kXu']*10**-10) * keV_per_J, 3)
# FIXME If needed, add energies for L-edges as well.