{ "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" [ [ 0.19695 0.77855 2.710152 ] [ 1.11009 0.0001542 2.008775 ] [ 0.4144899 1.96716 0.2031325 ] [ 1.283205 2.99395 1.505794 ] [ 2.698669 0.3602939 2.825256 ] [ 2.163799 2.696333 2.742799 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9695e-11 7.7855e-11 2.710152e-10 ] [ 1.11009e-10 1.542e-14 2.008775e-10 ] [ 4.144899e-11 1.96716e-10 2.031325e-11 ] [ 1.283205e-10 2.99395e-10 1.505794e-10 ] [ 2.698669e-10 3.602939e-11 2.825256e-10 ] [ 2.163799e-10 2.696333e-10 2.742799e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -121.305764 106.5915993 101.3413494 ] [ 97.7093452 -113.0109803 -112.8913919 ] [ -12.9285199 -28.951226 -25.3860821 ] [ -54.1535347 60.0411569 -72.0904088 ] [ 21.8643759 7.9018764 11.8578871 ] [ 68.8140976 -32.5724262 97.1686463 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.943532590490823e-07 1.707785683721416e-07 1.623667407290041e-07 ] [ 1.565476285131167e-07 -1.810635505303494e-07 -1.808719487917505e-07 ] [ -2.071377232532755e-08 -4.63849774406971e-08 -4.067298723432936e-08 ] [ -8.676352723002154e-08 9.61965378709646e-08 -1.155015675632746e-07 ] [ 3.503059189536296e-08 1.266020162853127e-08 1.899842948370591e-08 ] [ 1.102523383561694e-07 -5.218677974037339e-08 1.556813333766444e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 81.267754 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.302052954837257e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.2071071 1.0359634 3.5414366 ] [ 0.9204369 -0.1864831 1.6440662 ] [ 0.6540659 1.5018866 -0.1600702 ] [ 1.4088961 3.5580456 1.1565975 ] [ 3.2087407 0.4537974 2.4922679 ] [ 1.8821703 2.4332311 3.3216106 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.071071e-11 1.0359634e-10 3.5414366e-10 ] [ 9.204369e-11 -1.864831e-11 1.6440662e-10 ] [ 6.540659e-11 1.5018866e-10 -1.600702e-11 ] [ 1.4088961e-10 3.5580456e-10 1.1565975e-10 ] [ 3.2087407e-10 4.537974e-11 2.4922679e-10 ] [ 1.8821703e-10 2.4332311e-10 3.3216106e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.99e-05 6.6e-06 1.92e-05 ] [ -5.2e-06 -8.1e-06 -1.99e-05 ] [ -8e-07 2.18e-05 1.2e-05 ] [ 2.4e-06 -3.05e-05 1.97e-05 ] [ 3.8e-05 -9.1e-06 1.18e-05 ] [ -1.44e-05 1.93e-05 -4.28e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.188331475392e-14 1.057436569728e-14 3.076179111936e-14 ] [ -8.33131842816e-15 -1.297763062848e-14 -3.188331475392e-14 ] [ -1.28174129664e-15 3.492745033344e-14 1.92261194496e-14 ] [ 3.84522388992e-15 -4.88663869344e-14 3.156287942976e-14 ] [ 6.08827115904e-14 -1.457980724928e-14 1.890568412544e-14 ] [ -2.307134333952e-14 3.092200878144e-14 -6.857315937023999e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.273917 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.767586596703968e-18 } }