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. 2021 Dec 23;9(Pt 1):146–162. doi: 10.1107/S2052252521012628

Table 2. Net atomic charge Ω (e) at atoms/ions and atomic/ionic volumes V3).

  Ag_exp Ω, V Ag_exp (APS completeness) Ω, V Mo_exp Ω, V APS_exp Ω V
K1 +1.16, 19.0 +1.15, 19.1 +1.21, 18.0 +1.18, 19.5
K2 +1.12, 20.0 +1.09, 19.9 +0.99, 19.8 +0.63, 19.9
S3 +3.06, 5.6 +3.13, 5.4 +3.13, 5.6 +3.64, 4.4
Mg4 +1.53, 5.3 +1.55, 5.1 +1.85, 4.2 +1.78, 4.5
Mg5 +1.55, 5.8 +1.56, 5.8 +1.91, 4.3 +1.71, 5.4
O6 −1.03, 13.2 −1.08, 13.4 −1.29, 14.2 −1.28, 14.9
O7 −1.09, 15.4 −1.10, 15.6 −1.35, 16.0 −1.03, 14.9
O8 −1.02, 13.8 −1.05, 14.0 −1.10, 14.8 −1.07, 13.9
O9 −1.72, 17.2 −1.7, 16.9 −1.46, 16.3 −2.05, 18.4
Total charge −0.16 −0.20 −1.00 −0.28
Total volume 982.8 983.2 988.0 995.2