{ "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" [ [ 2.841627 2.849258 1.50686 ] [ 0.998489 4.149663 3.105849 ] [ 4.765797 1.647113 1.498592 ] [ 3.299037 1.906995 3.475865 ] [ 3.256514 4.175642 3.223298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.841627e-10 2.849258e-10 1.50686e-10 ] [ 9.98489e-11 4.149663e-10 3.105849e-10 ] [ 4.765797e-10 1.647113e-10 1.498592e-10 ] [ 3.299037e-10 1.906995e-10 3.475865e-10 ] [ 3.256514e-10 4.175642e-10 3.223298000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3421895 0.7523358 -1.7874031 ] [ 1.1027274 -1.211608 -0.7425586 ] [ 0.2773745 -0.7326603 0.7314165 ] [ 0.4820633 -0.8207576 0.2791858 ] [ 0.4800243 2.0126902 1.5193594 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.752601258383241e-09 1.205374829750865e-09 -2.863735458765444e-09 ] [ 1.76676405939557e-09 -1.941210011174247e-09 -1.189710028493979e-09 ] [ 4.444029391060896e-10 -1.173851203648314e-09 1.171858416367363e-09 ] [ 7.723505490056966e-10 -1.314998638063918e-09 4.473049616193446e-10 ] [ 7.690837108758855e-10 3.224685183353276e-09 2.434282109272716e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.991778 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.882600607822378e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9994387 3.3546237 1.2905974 ] [ 1.3390824 3.2653929 2.959235 ] [ 4.1733984 1.4029458 1.6283065 ] [ 3.3252047 2.1852192 3.6207651 ] [ 3.3243398 4.5204895 3.31156 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9994387e-10 3.3546237e-10 1.2905974e-10 ] [ 1.3390824e-10 3.2653929e-10 2.959235e-10 ] [ 4.1733984e-10 1.4029458e-10 1.6283065e-10 ] [ 3.3252047e-10 2.1852192e-10 3.6207651e-10 ] [ 3.3243398e-10 4.5204895e-10 3.31156e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.7e-06 -3.9e-06 3.21e-05 ] [ 2.98e-05 6.2e-06 -1.81e-05 ] [ -1.26e-05 -9.5e-06 -4.5e-06 ] [ 1.08e-05 1.4e-05 -1.14e-05 ] [ -2.43e-05 -6.8e-06 1.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.928053496960001e-15 -6.24848882112e-15 5.142986952768e-14 ] [ 4.774486329984001e-14 9.93349504896e-15 -2.899939683648e-14 ] [ -2.018742542208e-14 -1.52206778976e-14 -7.2097947936e-15 ] [ 1.730350750464e-14 2.24304726912e-14 -1.826481347712e-14 ] [ -3.893289188544e-14 -1.089480102144e-14 3.04413557952e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.206918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.23750515980227e-18 } }