{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 12.9340986 -8.6791198 -19.6126287 ] [ -81.947662 -100.0930019 53.1420459 ] [ -81.4248741 8.2575207 -36.6615875 ] [ -24.8613519 -13.8375931 -112.5901962 ] [ -8.3506422 103.9098935 115.4107695 ] [ 41.7730105 4.6159017 -62.4888061 ] [ 141.8774212 5.8263989 62.8004031 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.072271055877211e-08 -1.390548294724675e-08 -3.142289543445779e-08 ] [ -1.312946292673297e-07 -1.603666688710976e-07 8.514294422393549e-08 ] [ -1.304570307094118e-07 1.323000672031132e-08 -5.873833885784647e-08 ] [ -3.98322771038315e-08 -2.217026833561963e-08 -1.803893815691156e-07 ] [ -1.337920381173435e-08 1.664820034071285e-07 1.849084382048598e-07 ] [ 6.692774135493665e-08 7.395489848580877e-09 -1.001181050199766e-07 ] [ 2.273126891388162e-07 9.334920177943302e-09 1.006173384526012e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 61.03411 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.778742491898573e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6414496 1.8187547 1.4466606 ] [ 2.7036716 2.3522397 4.2349572 ] [ 1.6712657 4.3772092 2.2056747 ] [ 5.1487838 2.7739677 1.1242354 ] [ 5.4803339 2.7638329 3.8062294 ] [ 4.1892406 5.296189 1.2684726 ] [ 3.9413397 5.1329268 4.0924701 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6414496e-10 1.8187547e-10 1.4466606e-10 ] [ 2.7036716e-10 2.3522397e-10 4.2349572e-10 ] [ 1.6712657e-10 4.3772092e-10 2.2056747e-10 ] [ 5.1487838e-10 2.7739677e-10 1.1242354e-10 ] [ 5.4803339e-10 2.7638329e-10 3.8062294e-10 ] [ 4.1892406e-10 5.296189e-10 1.2684726e-10 ] [ 3.9413397e-10 5.1329268e-10 4.0924701e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.9e-06 -1.24e-05 1.59e-05 ] [ 0.0 -3.22e-05 -1.2e-06 ] [ -1.5e-05 1.67e-05 -1.96e-05 ] [ 1.59e-05 8.4e-06 -8e-06 ] [ 1.4e-06 -1.66e-05 1.9e-06 ] [ -5e-06 -1.7e-06 9.3e-06 ] [ 1.25e-05 3.78e-05 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.58615486766e-14 -1.98669902616e-14 2.54746084806e-14 ] [ 0.0 -5.159008761479998e-14 -1.9226119608e-15 ] [ -2.403264951e-14 2.67563497878e-14 -3.140266202639999e-14 ] [ 2.54746084806e-14 1.34582837256e-14 -1.2817413072e-14 ] [ 2.2430472876e-15 -2.65961321244e-14 3.0441356046e-15 ] [ -8.010883169999999e-15 -2.7237002778e-15 1.49002426962e-14 ] [ 2.0027207925e-14 6.056227676519999e-14 2.7237002778e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.651734 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.148554903238336e-18 } }