{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.063375 0.5708417 2.359419 ] [ 2.68579 2.886891 2.868985 ] [ 0.6763911 2.686272 1.583941 ] [ 2.607368 0.7750333 4.497523 ] [ 3.625325 0.6457468 2.38821 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.063375e-10 5.708417e-11 2.359419e-10 ] [ 2.68579e-10 2.886891e-10 2.868985e-10 ] [ 6.763911e-11 2.686272e-10 1.583941e-10 ] [ 2.607368e-10 7.750333e-11 4.497523e-10 ] [ 3.625325e-10 6.457468e-11 2.38821e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1012916 -2.0818681 -1.7253779 ] [ 0.1898352 4.1919202 -0.8866565 ] [ 0.3651689 0.3220417 0.5145649 ] [ 0.1093379 -1.0279623 3.526354 ] [ 3.4369496 -1.4041315 -1.4288845 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.570993516603425e-09 -3.335520397409316e-09 -2.764360133425001e-09 ] [ 3.041495192448922e-10 6.716196540699261e-09 -1.420580314980355e-09 ] [ 5.850650742232531e-10 5.159676826626874e-10 8.244238526642899e-10 ] [ 1.751786271473684e-10 -1.646977164123796e-09 5.649841935464563e-09 ] [ 5.506600295987912e-09 -2.249666661828835e-09 -2.289325339723497e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.551039 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.370027476934901e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6898091 0.856122 2.0574892 ] [ 2.2323073 3.2754284 2.5873274 ] [ 0.3649052 2.9549333 1.4535921 ] [ 3.2592919 0.3753863 4.6186211 ] [ 4.1119356 0.1029148 2.9810482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.898091e-11 8.56122e-11 2.0574892e-10 ] [ 2.2323073e-10 3.2754284e-10 2.5873274e-10 ] [ 3.649052e-11 2.9549333e-10 1.4535921e-10 ] [ 3.2592919e-10 3.753863e-11 4.6186211e-10 ] [ 4.1119356e-10 1.029148e-11 2.9810482e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-06 -4.7e-06 -2.3e-06 ] [ 2.5e-06 6.9e-06 3e-07 ] [ 2.5e-06 -2.2e-06 2e-06 ] [ -4.7e-06 1.5e-06 9.1e-06 ] [ 4.7e-06 -1.5e-06 -9.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-15 -7.53023011776e-15 -3.68500622784e-15 ] [ 4.005441552e-15 1.105501868352e-14 4.8065298624e-16 ] [ 4.005441552e-15 -3.52478856576e-15 3.2043532416e-15 ] [ -7.53023011776e-15 2.4032649312e-15 1.457980724928e-14 ] [ 7.53023011776e-15 -2.4032649312e-15 -1.457980724928e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.135307 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.065814150723059e-18 } }