{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.995263 -5.6160706 -2.0903762 ] [ -4.9692283 3.1607206 4.5114362 ] [ -3.3346174 0.5234449 -0.5586348 ] [ 3.2042733 -1.3293513 -2.044029 ] [ 5.3075403 -3.3345404 3.0944987 ] [ 1.1161411 -0.6823571 -7.4137628 ] [ 3.671154 7.2781539 4.5008679 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.00329359334727e-09 -8.997937016082228e-09 -3.349151876316745e-09 ] [ -7.961581405677729e-09 5.064032650200949e-09 7.228117605870794e-09 ] [ -5.342646037592881e-09 8.386511810569939e-10 -8.950316161252838e-10 ] [ 5.133811767913665e-09 -2.129855573690087e-09 -3.274895476037203e-09 ] [ 8.50361698261382e-09 -5.34252266999308e-09 4.957933470235993e-09 ] [ 1.788255175933995e-09 -1.093256592656888e-09 -1.187815743031674e-08 ] [ 5.881837110156403e-09 1.166088802116434e-08 7.211185322689193e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.763394 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.8460094572859e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7918407 1.2357173 2.5578157 ] [ 2.1471873 3.0523971 4.2700345 ] [ 1.4150668 3.5335339 1.985667 ] [ 4.0428095 1.5350253 2.0966487 ] [ 4.434194 2.4378574 4.2166857 ] [ 3.6186948 3.7352472 1.3063357 ] [ 4.3314118 4.5919268 3.3263277 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7918407e-10 1.2357173e-10 2.5578157e-10 ] [ 2.1471873e-10 3.0523971e-10 4.2700345e-10 ] [ 1.4150668e-10 3.5335339e-10 1.985667e-10 ] [ 4.0428095e-10 1.5350253e-10 2.0966487e-10 ] [ 4.434194e-10 2.4378574e-10 4.2166857e-10 ] [ 3.6186948e-10 3.7352472e-10 1.3063357e-10 ] [ 4.3314118e-10 4.5919268e-10 3.326327700000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-06 -2.4e-05 2.1e-05 ] [ 6.97e-05 7.4e-06 -3.75e-05 ] [ 3.25e-05 -1.74e-05 1.3e-05 ] [ -3.32e-05 1.89e-05 -3.75e-05 ] [ -6.22e-05 6.9e-05 -7.2e-06 ] [ 1.1e-05 -1.1e-06 1.68e-05 ] [ -1.37e-05 -5.29e-05 3.14e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.4087064832e-15 -3.84522388992e-14 3.36457090368e-14 ] [ 1.1167171046976e-13 1.185610699392e-14 -6.008162327999999e-14 ] [ 5.207074017599999e-14 -2.787787320192e-14 2.08282960704e-14 ] [ -5.319226381056e-14 3.028113813312e-14 -6.008162327999999e-14 ] [ -9.965538581376e-14 1.105501868352e-13 -1.153567166976e-14 ] [ 1.76239428288e-14 -1.76239428288e-15 2.691656722944e-14 ] [ -2.194981970496e-14 -8.475514324032001e-14 5.030834589312e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.30335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573390593551968e-18 } }