{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.051005 1.466214 2.567615 ] [ 0.3372835 2.721373 0.2523551 ] [ 2.822669 2.541764 0.4147021 ] [ 2.595922 2.673872 2.566842 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.051005e-10 1.466214e-10 2.567615e-10 ] [ 3.372835e-11 2.721373e-10 2.523551e-11 ] [ 2.822669e-10 2.541764e-10 4.147021e-11 ] [ 2.595922e-10 2.673872e-10 2.566842e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.3805098 -3.5478246 -0.861593 ] [ 1.3209903 -0.5363524 0.8740617 ] [ -0.8820614 -0.068046 -2.2939877 ] [ 4.9415809 4.152223 2.2815191 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.620527009545283e-09 -5.684241628819112e-09 -1.380424161244934e-09 ] [ 2.116459774963578e-09 -8.593312757899699e-10 1.400401220876703e-09 ] [ -1.413218153190117e-09 -1.090217103389568e-10 -3.675373461342764e-09 ] [ 7.917285387771823e-09 6.652594614948039e-09 3.655396561928658e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.2059416203271205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.534308090937783e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.650948 1.7438043 2.5897181 ] [ 0.5059283 2.2548985 0.2964472 ] [ 2.7524951 2.9577977 0.3110367 ] [ 2.8975081 2.4467225 2.6043122 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.50948e-11 1.7438043e-10 2.5897181e-10 ] [ 5.059283e-11 2.2548985e-10 2.964472e-11 ] [ 2.7524951e-10 2.9577977e-10 3.110367e-11 ] [ 2.8975081e-10 2.4467225e-10 2.6043122e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.4e-06 -7e-07 3e-06 ] [ 4.5e-06 2e-07 -1e-06 ] [ -2.8e-06 1.2e-06 -2.7e-06 ] [ 2.7e-06 -7e-07 7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.04957713152e-15 -1.12152363456e-15 4.8065298624e-15 ] [ 7.2097947936e-15 3.2043532416e-16 -1.6021766208e-15 ] [ -4.48609453824e-15 1.92261194496e-15 -4.32587687616e-15 ] [ 4.32587687616e-15 -1.12152363456e-15 1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -3.86421462032712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.19115432244166e-19 } }