{ "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" [ [ 2.164327 2.183765 1.328393 ] [ 2.70587 2.068279 5.162644 ] [ 0.8559813 1.907046 3.441903 ] [ 2.386273 0.2061938 3.516969 ] [ 3.489815 3.035472 2.979319 ] [ 4.556806 1.225964 3.894732 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.164327e-10 2.183765e-10 1.328393e-10 ] [ 2.70587e-10 2.068279e-10 5.162644000000001e-10 ] [ 8.559813e-11 1.907046e-10 3.441903e-10 ] [ 2.386273e-10 2.061938e-11 3.516969e-10 ] [ 3.489815e-10 3.035472e-10 2.979319e-10 ] [ 4.556806e-10 1.225964e-10 3.894732e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5635419 -0.0610088 -2.265432 ] [ -1.4058126 2.3628479 8.57746 ] [ -6.100267 1.9608862 -0.1476121 ] [ 0.3183895 -6.8003789 -2.6512936 ] [ 2.2885034 5.0031649 -4.0921559 ] [ 5.4627286 -2.4655113 0.5790336 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.028936570212116e-10 -9.774687302306305e-11 -3.629622186412186e-09 ] [ -2.252360080946062e-09 3.785699663886377e-09 1.374260587784717e-08 ] [ -9.773705168037753e-09 3.141686025689353e-09 -2.365006555671917e-10 ] [ 5.101162132082016e-10 -1.089540808616162e-08 -4.247840620796666e-09 ] [ 3.666586644101311e-09 8.01595383278717e-09 -6.556356511648782e-09 ] [ 8.752256048695516e-09 -3.950184563178215e-09 9.27714096577659e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -2.245583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.597820582665926e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2879773 2.272889 1.2058545 ] [ 2.3554137 2.1774438 5.4489746 ] [ 0.6763987 2.0322679 3.8162682 ] [ 2.6056615 -0.1027565 3.3783537 ] [ 3.630482 3.1255953 2.6445432 ] [ 4.603139 1.1212804 3.8299658 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2879773e-10 2.272889e-10 1.2058545e-10 ] [ 2.3554137e-10 2.1774438e-10 5.4489746e-10 ] [ 6.763987e-11 2.0322679e-10 3.8162682e-10 ] [ 2.6056615e-10 -1.027565e-11 3.3783537e-10 ] [ 3.630482e-10 3.1255953e-10 2.6445432e-10 ] [ 4.603139e-10 1.1212804e-10 3.8299658e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.692531 -0.0737183 1.3720334 ] [ -3.9640024 0.1459927 -1.4905837 ] [ 0.5077049 1.593234 3.2536111 ] [ 3.7678522 0.0481194 -0.3073051 ] [ 0.8941885 -0.7849261 -1.0124031 ] [ -1.8982742 -0.9287017 -1.8153526 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.109556977379245e-09 -1.181097367851206e-10 2.198239836436735e-09 ] [ -6.351031970075091e-09 2.339060907474682e-10 -2.388178355485561e-09 ] [ 8.134329210456019e-10 2.552642266263667e-09 5.21285963759537e-09 ] [ 6.036764705469846e-09 7.709577768692353e-11 -4.92357046672606e-10 ] [ 1.432647909288221e-09 -1.257590246475723e-09 -1.622048577645445e-09 ] [ -3.041370543107824e-09 -1.487944151437215e-09 -2.908515494228494e-09 ] ] } "relaxed-potential-energy" { "source-value" -14.794572 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.37035173731423e-18 } }