{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.1028 0.2583089 1.436622 ] [ 0.0542075 1.282802 2.764068 ] [ 0.3917807 2.567162 0.7355983 ] [ 2.495357 1.268739 0.0869323 ] [ 2.96001 0.2024969 2.578704 ] [ 2.541972 2.542294 2.28683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1028e-10 2.583089e-11 1.436622e-10 ] [ 5.42075e-12 1.282802e-10 2.764068e-10 ] [ 3.917807e-11 2.567162e-10 7.355983000000001e-11 ] [ 2.495357e-10 1.268739e-10 8.693230000000001e-12 ] [ 2.96001e-10 2.024969e-11 2.578704e-10 ] [ 2.541972e-10 2.542294e-10 2.28683e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6702306 -7.7664651 -6.0490453 ] [ -4.8532191 5.3021327 5.9702966 ] [ 0.1493986 0.3190402 0.2209064 ] [ 1.5659251 2.0284917 -1.281766 ] [ 2.2643917 0.2074797 1.5803135 ] [ 0.2032731 -0.0906791 -0.4407053 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.073827797864757e-09 -1.244324880947913e-08 -9.691638957820124e-09 ] [ -7.775714177640017e-09 8.49495305231918e-09 9.565469631761731e-09 ] [ 2.393629441002509e-10 5.111587495353561e-10 3.539310694650932e-10 ] [ 2.508888585143902e-09 3.250001977226848e-09 -2.053615518536333e-09 ] [ 3.627955442073568e-09 3.324191246305977e-10 2.531941343234621e-09 ] [ 3.256794084575406e-10 -1.452839340151853e-10 -7.060877283226503e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -13.405104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.147734422819256e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2660581 -0.2561362 1.5516203 ] [ -0.3829437 1.2165083 2.2872976 ] [ 0.6270544 2.9601286 1.1644394 ] [ 2.0438882 1.3696891 0.0477857 ] [ 3.142812 0.3272036 2.8320858 ] [ 2.849258 2.5044094 2.0055258 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2660581e-10 -2.561362e-11 1.5516203e-10 ] [ -3.829437e-11 1.2165083e-10 2.2872976e-10 ] [ 6.270544e-11 2.9601286e-10 1.1644394e-10 ] [ 2.0438882e-10 1.3696891e-10 4.77857e-12 ] [ 3.142812e-10 3.272036e-11 2.8320858e-10 ] [ 2.849258e-10 2.5044094e-10 2.0055258e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.2439453 0.0284953 0.0132641 ] [ -0.3513642 -0.241976 0.1423095 ] [ 0.3843447 0.0090309 -0.0963763 ] [ -0.2960776 0.2560037 -0.1938274 ] [ -0.092313 -0.0666053 0.276077 ] [ 0.1114647 0.0150514 -0.141447 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.908434564140423e-10 4.565450346268224e-11 2.125143091595328e-11 ] [ -5.629475066260954e-10 -3.876882899947008e-10 2.280049538177376e-10 ] [ 6.157880926683898e-10 1.446909684478272e-11 -1.54411854659207e-10 ] [ -4.743686086625741e-10 4.10163142978297e-10 -3.105457287504499e-10 ] [ -1.479017303959104e-10 -1.067134544813703e-10 4.423241149406017e-10 ] [ 1.785861363844858e-10 2.411500119030912e-11 -2.266230764822976e-10 ] ] } "relaxed-potential-energy" { "source-value" -17.970564 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.879201750339013e-18 } }