{ "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" [ [ 1.697876 3.711698 1.143091 ] [ 3.423522 2.241155 2.183353 ] [ 3.951754 3.941629 0.5726112 ] [ 3.96365 5.193256 2.218192 ] [ 5.084028 3.36384 3.521791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.697876e-10 3.711698e-10 1.143091e-10 ] [ 3.423522e-10 2.241155e-10 2.183353e-10 ] [ 3.951754000000001e-10 3.941629e-10 5.726112e-11 ] [ 3.96365e-10 5.193256e-10 2.218192e-10 ] [ 5.084028e-10 3.36384e-10 3.521791e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.2721117 -0.9509281 -3.119078 ] [ -0.2496237 -17.1678015 4.5520001 ] [ 3.948043 1.7226478 -13.7657636 ] [ 7.0309852 16.9313785 6.6890471 ] [ 2.5427071 -0.5352967 5.6437944 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.126426707438614e-08 -1.523554769881765e-09 -4.997313850051623e-09 ] [ -3.99941256137593e-10 -2.750585019383517e-08 7.293108138099262e-09 ] [ 6.325462192513094e-09 2.759986031032554e-09 -2.205518460737964e-08 ] [ 1.126488010863081e-08 2.712705879061578e-08 1.071703487905004e-08 ] [ 4.073865869162167e-09 -8.576398579313913e-10 9.042355440281964e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.2603635 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.019324933409661e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1627155 2.9253918 0.7954941 ] [ 3.0374308 1.966607 2.7570562 ] [ 3.3080362 4.9410139 0.3984648 ] [ 4.8898516 5.2284898 2.1152388 ] [ 4.7227959 3.3900755 3.5727842 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1627155e-10 2.9253918e-10 7.954941e-11 ] [ 3.0374308e-10 1.966607e-10 2.7570562e-10 ] [ 3.3080362e-10 4.9410139e-10 3.984648e-11 ] [ 4.8898516e-10 5.2284898e-10 2.1152388e-10 ] [ 4.722795900000001e-10 3.3900755e-10 3.5727842e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.36e-05 -2.3e-05 -3.13e-05 ] [ -7.3e-06 1.08e-05 2.64e-05 ] [ -7.71e-05 1.87e-05 -2.65e-05 ] [ 7.5e-05 2.02e-05 1.65e-05 ] [ -1.42e-05 -2.67e-05 1.49e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.781136825088e-14 -3.68500622784e-14 -5.014812823104e-14 ] [ -1.169588933184e-14 1.730350750464e-14 4.229746278912e-14 ] [ -1.2352781746368e-13 2.996070280896e-14 -4.24576804512e-14 ] [ 1.2016324656e-13 3.236396774016e-14 2.64359142432e-14 ] [ -2.275090801536e-14 -4.277811577536e-14 2.387243164992e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }