{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.1244298e-10 2.492265e-11 1.8665007e-10 ] [ 1.0941677e-10 2.3923586e-10 2.5596793e-10 ] [ 2.6636895e-10 1.891569e-11 2.229108e-11 ] ] "source-value" [ [ 1.1244298 0.2492265 1.8665007 ] [ 1.0941677 2.3923586 2.5596793 ] [ 2.6636895 0.1891569 0.2229108 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.7639964595008e-13 2.6467957775616e-13 2.6788393099776e-13 ] [ 2.1613362614592e-13 -5.5611550507968e-13 -3.997430668896e-13 ] [ -3.973398019584e-14 2.9143592732352e-13 1.3185913589184e-13 ] ] "source-value" [ [ -0.0001101 0.0001652 0.0001672 ] [ 0.0001349 -0.0003471 -0.0002495 ] [ -2.48e-05 0.0001819 8.23e-05 ] ] } "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" -9.793002904782304e-19 "source-value" -6.1123117 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.366436882168795e-07 -1.892551090090474e-08 1.384208806836822e-07 ] [ 1.509314463858432e-10 -3.398614272954083e-09 -1.20793334559662e-09 ] [ 1.364927567704937e-07 2.232412533407648e-08 -1.372129473380856e-07 ] ] "source-value" [ [ -85.2862827 -11.8123749 86.395519 ] [ 0.094204 -2.1212482 -0.7539327 ] [ 85.1920787 13.9336232 -85.6415863 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 4.250734472209156e-18 "source-value" 26.530998 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.415923e-10 8.167959e-12 1.507066e-10 ] [ 1.16354e-10 2.518736e-10 2.525432e-10 ] [ 2.302824e-10 2.303264e-11 6.165928000000001e-11 ] ] "source-value" [ [ 1.415923 0.08167959 1.507066 ] [ 1.16354 2.518736 2.525432 ] [ 2.302824 0.2303264 0.6165928 ] ] } "instance-id" 1 }