{ "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" [ [ 2.905521 1.741541 1.432593 ] [ 2.475113 5.398899 1.710867 ] [ 1.47054 3.340259 2.516001 ] [ 3.027539 3.458512 0.3041981 ] [ 3.800453 3.660633 2.737021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.905521e-10 1.741541e-10 1.432593e-10 ] [ 2.475113e-10 5.398899000000001e-10 1.710867e-10 ] [ 1.47054e-10 3.340259e-10 2.516001e-10 ] [ 3.027539e-10 3.458512e-10 3.041981e-11 ] [ 3.800453e-10 3.660633e-10 2.737021e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9148388 -0.1864209 2.8392907 ] [ 2.5420246 -13.7619425 3.3430116 ] [ 15.278605 4.7984365 -2.2355493 ] [ -0.5570152 5.0651999 0.4781045 ] [ -15.3487755 4.084727 -4.4248574 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.067909957960727e-09 -2.986792076084947e-10 4.549045179194867e-09 ] [ 4.072772383618472e-09 -2.20490625302939e-08 5.356095028583201e-09 ] [ 2.447902372943798e-08 7.68794277669338e-09 -3.581744823105806e-09 ] [ -8.924367308702363e-10 8.115344859458498e-09 7.660078521992735e-10 ] [ -2.459144926400783e-08 6.544454101750522e-09 -7.089403076653874e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.7867668 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.66924585618163e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3182126 1.8316477 1.0264677 ] [ 3.3002112 5.258932 1.3023617 ] [ 2.240298 2.3945873 3.1621345 ] [ 2.9732891 3.6019075 -0.1229226 ] [ 2.8471551 4.5127695 3.3326388 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3182126e-10 1.8316477e-10 1.0264677e-10 ] [ 3.3002112e-10 5.258932e-10 1.3023617e-10 ] [ 2.240298e-10 2.3945873e-10 3.1621345e-10 ] [ 2.9732891e-10 3.6019075e-10 -1.229226e-11 ] [ 2.8471551e-10 4.5127695e-10 3.3326388e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.86e-05 2.93e-05 3.38e-05 ] [ -3.66e-05 -3.97e-05 7.7e-06 ] [ -2.87e-05 2e-05 -3.49e-05 ] [ 1.5e-06 8.9e-06 1.11e-05 ] [ 3.53e-05 -1.85e-05 -1.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.582225135488e-14 4.694377498944e-14 5.415356978304e-14 ] [ -5.863966432128e-14 -6.360641184576e-14 1.233675998016e-14 ] [ -4.598246901696e-14 3.2043532416e-14 -5.591596406592e-14 ] [ 2.4032649312e-15 1.425937192512e-14 1.778416049088e-14 ] [ 5.655683471424e-14 -2.96402674848e-14 -2.835852618816e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.370748 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.821794660660836e-18 } }