{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9468774 0.7404637 -0.9215426 ] [ -5.1084259 4.3736548 -1.3619634 ] [ 5.615677 -6.341526 7.2218482 ] [ 1.3905093 -0.3865313 -5.3518037 ] [ -0.6516205 -0.133711 -1.8880766 ] [ -0.0220254 -1.8154902 -0.0018923 ] [ -2.1709919 3.5631399 2.3034304 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.517064845542671e-09 1.186353638465186e-09 -1.476474020955608e-09 ] [ -8.18460061350042e-09 7.007367525741942e-09 -2.182105935843195e-09 ] [ 8.997306473491215e-09 -1.016024478110348e-08 1.157067644033496e-08 ] [ 2.227841509819696e-09 -6.192914171696442e-10 -8.574534837894745e-09 ] [ -1.044011139335397e-09 -2.14228639908774e-10 -3.025032211722164e-09 ] [ -3.528858123450359e-11 -2.908735977695986e-09 -3.0317988445182e-12 ] [ -3.478312494783265e-09 5.708779491453095e-09 3.690502364925273e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 6.5314777236328325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.046458099429603e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.9468774 0.7404637 -0.9215426 ] [ -5.1084259 4.3736548 -1.3619634 ] [ 5.615677 -6.341526 7.2218482 ] [ 1.3905093 -0.3865313 -5.3518037 ] [ -0.6516205 -0.133711 -1.8880766 ] [ -0.0220254 -1.8154902 -0.0018923 ] [ -2.1709919 3.5631399 2.3034304 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.517064845542671e-09 1.186353638465186e-09 -1.476474020955608e-09 ] [ -8.18460061350042e-09 7.007367525741942e-09 -2.182105935843195e-09 ] [ 8.997306473491215e-09 -1.016024478110348e-08 1.157067644033496e-08 ] [ 2.227841509819696e-09 -6.192914171696442e-10 -8.574534837894745e-09 ] [ -1.044011139335397e-09 -2.14228639908774e-10 -3.025032211722164e-09 ] [ -3.528858123450359e-11 -2.908735977695986e-09 -3.0317988445182e-12 ] [ -3.478312494783265e-09 5.708779491453095e-09 3.690502364925273e-09 ] ] } "relaxed-potential-energy" { "source-value" 6.5314777236328325 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.046458099429603e-18 } }