{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 9.359116e-11 7.569848000000001e-11 8.044636e-11 ] [ 2.2568327e-10 2.631161e-10 4.988536000000001e-11 ] [ 1.8948303e-10 1.8062008e-10 2.6293986e-10 ] ] "source-value" [ [ 0.9359116 0.7569848 0.8044636 ] [ 2.2568327 2.631161 0.4988536 ] [ 1.8948303 1.8062008 2.6293986 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.2032346422208e-13 -1.546100439072e-13 -7.818621909504e-14 ] [ 5.271161082432e-14 5.944075263168e-14 8.892080245440001e-14 ] [ 6.761185339776e-14 9.516929127552e-14 -1.073458335936e-14 ] ] "source-value" [ [ -7.51e-05 -9.65e-05 -4.88e-05 ] [ 3.29e-05 3.71e-05 5.55e-05 ] [ 4.22e-05 5.94e-05 -6.7e-06 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.261083135704963e-18 "source-value" -7.8710619 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 7.753765799894015e-11 4.211088932162784e-10 -2.06314670703581e-09 ] [ -1.394253669182694e-09 -2.342782122894152e-09 2.719262546555708e-09 ] [ 1.316716011183754e-09 1.921673069460211e-09 -6.561158395198984e-10 ] ] "source-value" [ [ 0.0483952 0.2628355 -1.2877149 ] [ -0.8702247 -1.4622496 1.6972302 ] [ 0.8218295 1.199414 -0.4095153 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.199473083994018e-18 "source-value" -7.4865222 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 9.494976000000001e-11 7.633406e-11 8.86263e-11 ] [ 2.303045e-10 2.715974e-10 3.616398e-11 ] [ 1.835032e-10 1.715032e-10 2.684813e-10 ] ] "source-value" [ [ 0.9494976 0.7633406 0.886263 ] [ 2.303045 2.715974 0.3616398 ] [ 1.835032 1.715032 2.684813 ] ] } "instance-id" 1 }