{ "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" [ [ 1.483855 3.232448 1.251337 ] [ 3.689866 2.398626 1.235866 ] [ 3.590905 4.264079 2.332914 ] [ 5.55038 3.265447 1.999914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.483855e-10 3.232448e-10 1.251337e-10 ] [ 3.689866e-10 2.398626e-10 1.235866e-10 ] [ 3.590905e-10 4.264079e-10 2.332914e-10 ] [ 5.55038e-10 3.265447e-10 1.999914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.1474918 -2.9362852 -0.1835125 ] [ -9.9201929 -1.7312141 -2.9893508 ] [ -2.4396572 4.7127795 2.4962489 ] [ 5.2123584 -0.0452802 0.6766143 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.145154425931971e-08 -4.704447499441052e-09 -2.9401943712456e-10 ] [ -1.589390113820615e-08 -2.773710756619314e-09 -4.789467963129777e-09 ] [ -3.90876172860639e-09 7.550705133885515e-09 3.999431627277717e-09 ] [ 8.351118767710495e-09 -7.254687782514815e-11 1.084055612758957e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.2653184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.833793420748063e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1480477 1.7493649 0.3118631 ] [ 3.0975315 2.4204212 1.0819243 ] [ 5.5159814 5.2960196 3.2936075 ] [ 4.5534454 3.6947943 2.132636 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1480477e-10 1.7493649e-10 3.118631e-11 ] [ 3.0975315e-10 2.4204212e-10 1.0819243e-10 ] [ 5.5159814e-10 5.296019600000001e-10 3.2936075e-10 ] [ 4.5534454e-10 3.6947943e-10 2.132636e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0684539 -0.0036487 0.0103013 ] [ -0.0246401 0.0642702 0.0350245 ] [ 0.0445645 0.0527073 0.0405817 ] [ -0.0883783 -0.1133287 -0.0859075 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.096752381825811e-10 -5.84586183631296e-12 1.650450202384704e-11 ] [ -3.947779215417409e-11 1.029722118541402e-10 5.61154350552096e-11 ] [ 7.14002000176416e-11 8.444640380549185e-11 6.501905097231936e-11 ] [ -1.415976460460486e-10 -1.81572593605657e-10 -1.37638988051376e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.4099403 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.347420973098374e-18 } }