{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.387016 -2.8196527 -2.9002889 ] [ 1.4612985 1.3249736 -0.1611407 ] [ -0.8034138 -0.5038483 0.642655 ] [ -1.9517988 -2.1048663 -2.7777108 ] [ 1.2565355 2.4517743 2.709618 ] [ -0.3812591 -0.8034175 0.8743072 ] [ 2.8056537 2.4550369 1.6125602 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.824421228675533e-09 -4.517581634715596e-09 -4.646775069145749e-09 ] [ 2.341258292710109e-09 2.122841725097211e-09 -2.581758621993466e-10 ] [ -1.287210807188087e-09 -8.072539666898248e-10 1.029646816240224e-09 ] [ -3.127126405865495e-09 -3.372367575769799e-09 -4.450383303103665e-09 ] [ 2.013191801305238e-09 3.928175462938285e-09 4.341286610898854e-09 ] [ -6.108444164872493e-10 -1.287216735241584e-09 1.40079455523711e-09 ] [ 4.495152764201018e-09 3.933402724381308e-09 2.583606252072572e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.612971158928929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.99297116406061e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.8899543 2.63705 1.6753327 ] [ 2.0343451 0.8140848 2.8672732 ] [ 2.6910085 2.7036204 4.2160894 ] [ 4.2417102 0.6990005 2.1119775 ] [ 4.9820888 2.1385071 3.8828618 ] [ 3.8014929 4.5556013 0.7878127 ] [ 4.1601941 4.2911477 3.0938116 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8899543e-10 2.63705e-10 1.6753327e-10 ] [ 2.0343451e-10 8.140848000000001e-11 2.8672732e-10 ] [ 2.6910085e-10 2.7036204e-10 4.2160894e-10 ] [ 4.2417102e-10 6.990005e-11 2.1119775e-10 ] [ 4.9820888e-10 2.1385071e-10 3.8828618e-10 ] [ 3.8014929e-10 4.5556013e-10 7.878127000000001e-11 ] [ 4.1601941e-10 4.2911477e-10 3.0938116e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.3e-06 -1.34e-05 2.7e-06 ] [ -4.72e-05 -6.6e-05 2.1e-06 ] [ 9.7e-06 -2.1e-06 -3.57e-05 ] [ -1.88e-05 2.85e-05 2.79e-05 ] [ 1.65e-05 1.81e-05 -2.34e-05 ] [ 8.7e-06 9.2e-06 6.5e-06 ] [ 2.58e-05 2.57e-05 1.98e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.491536090240001e-15 -2.146916671872e-14 4.32587687616e-15 ] [ -7.562273650176e-14 -1.057436569728e-13 3.36457090368e-15 ] [ 1.554111322176e-14 -3.36457090368e-15 -5.719770536256001e-14 ] [ -3.012092047104e-14 4.56620336928e-14 4.470072772032e-14 ] [ 2.64359142432e-14 2.899939683648e-14 -3.749093292672001e-14 ] [ 1.393893660096e-14 1.474002491136e-14 1.04141480352e-14 ] [ 4.133615681664e-14 4.117593915456e-14 3.172309709184e-14 ] ] } "relaxed-potential-energy" { "source-value" -7.913635158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.267904123717682e-18 } }