{ "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" [ [ 0.1837152 1.359189 0.2246076 ] [ 1.439885 0.3143995 0.1278355 ] [ 1.736921 1.45075 1.267781 ] [ 2.492617 0.9019618 2.872525 ] [ 2.597932 2.758406 2.155931 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.837152e-11 1.359189e-10 2.246076e-11 ] [ 1.439885e-10 3.143995e-11 1.278355e-11 ] [ 1.736921e-10 1.45075e-10 1.267781e-10 ] [ 2.492617e-10 9.019618e-11 2.872525e-10 ] [ 2.597932e-10 2.758406e-10 2.155931e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -16.1922813 7.8530628 -3.1376919 ] [ 6.9239268 -19.7805805 -12.6593616 ] [ 0.5971305 5.4257885 3.1540565 ] [ 2.7270894 -5.8365893 8.2182538 ] [ 5.9441345 12.3383185 4.4247432 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.594289453627703e-08 1.258199361983419e-08 -5.027136605453531e-09 ] [ 1.109335364309056e-08 -3.169198362295237e-08 -2.028253318977328e-08 ] [ 9.567085266666145e-10 8.693071484105501e-09 5.053355584982275e-09 ] [ 4.3692788795115e-09 -9.351246921671437e-09 1.316709410216076e-08 ] [ 9.523553326790699e-09 1.976816544068413e-08 7.089220108083779e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 1.9529072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.12890225843199e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.4475798 1.3213086 0.1956314 ] [ 1.6396023 0.0421742 -0.7016293 ] [ 1.6902206 1.3569448 1.3297425 ] [ 2.436515 0.9814177 3.6012224 ] [ 3.1323121 3.082861 2.2237131 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.475798000000001e-11 1.3213086e-10 1.956314e-11 ] [ 1.6396023e-10 4.21742e-12 -7.016293e-11 ] [ 1.6902206e-10 1.3569448e-10 1.3297425e-10 ] [ 2.436515e-10 9.814177e-11 3.6012224e-10 ] [ 3.1323121e-10 3.082861e-10 2.2237131e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.87e-05 2.27e-05 8e-07 ] [ -4.1e-06 -2.11e-05 7.5e-06 ] [ -1.37e-05 6.2e-06 2.5e-06 ] [ 1.88e-05 -7e-06 -1.38e-05 ] [ -2.96e-05 -8e-07 3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.598246901696e-14 3.636940929216e-14 1.28174129664e-15 ] [ -6.568924145279999e-15 -3.380592669888e-14 1.2016324656e-14 ] [ -2.194981970496e-14 9.93349504896e-15 4.005441552e-15 ] [ 3.012092047104e-14 -1.12152363456e-14 -2.211003736704e-14 ] [ -4.742442797568e-14 -1.28174129664e-15 4.8065298624e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.47182 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.998205842282586e-18 } }