{ "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" [ [ 1.63984 2.632724 3.733643 ] [ 2.059322 3.100925 1.548727 ] [ 0.4497259 4.960249 3.35449 ] [ 2.730005 4.489518 3.533282 ] [ 4.056337 2.434117 2.913545 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.63984e-10 2.632724e-10 3.733643e-10 ] [ 2.059322e-10 3.100925e-10 1.548727e-10 ] [ 4.497259e-11 4.960249e-10 3.35449e-10 ] [ 2.730005e-10 4.489518e-10 3.533282e-10 ] [ 4.056337e-10 2.434117e-10 2.913545e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9842232 -3.0880208 1.7452951 ] [ 0.8033996 -0.305602 -1.8923009 ] [ -0.1136667 -0.5405132 0.4847833 ] [ 2.5774413 3.8213221 -0.1435066 ] [ -0.282951 0.1128139 -0.194271 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.781252642288962e-09 -4.947554730304113e-09 2.796271005616798e-09 ] [ 1.287188056280072e-09 -4.896283796697216e-10 -3.031800261498799e-09 ] [ -1.821141293034873e-10 -8.659976122737946e-10 7.767084694142726e-10 ] [ 4.129516192344359e-09 6.12243292916636e-09 -2.299229194504973e-10 ] [ -4.533374770319808e-10 1.807477930812691e-10 -3.112564542994368e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.759516 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.884082160712353e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2046349 2.3383755 3.384605 ] [ 2.3305886 3.0891394 1.3931977 ] [ 0.9003947 4.5824088 4.0056883 ] [ 2.9139093 4.9189554 2.8453113 ] [ 3.5857024 2.6886538 3.4548847 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2046349e-10 2.3383755e-10 3.384605e-10 ] [ 2.3305886e-10 3.0891394e-10 1.3931977e-10 ] [ 9.003947e-11 4.5824088e-10 4.0056883e-10 ] [ 2.9139093e-10 4.9189554e-10 2.8453113e-10 ] [ 3.5857024e-10 2.6886538e-10 3.4548847e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.84e-05 3.94e-05 1.5e-06 ] [ 1.08e-05 -8.3e-06 -2.27e-05 ] [ 7.9e-06 -2.47e-05 1.27e-05 ] [ -1.34e-05 -1.9e-05 -9e-07 ] [ 1.32e-05 1.26e-05 9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.948004982272e-14 6.312575885952001e-14 2.4032649312e-15 ] [ 1.730350750464e-14 -1.329806595264e-14 -3.636940929216e-14 ] [ 1.265719530432e-14 -3.957376253376001e-14 2.034764308416e-14 ] [ -2.146916671872e-14 -3.04413557952e-14 -1.44195895872e-15 ] [ 2.114873139456e-14 2.018742542208e-14 1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.214602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.277430299837692e-18 } }