{ "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" [ [ 1.26541 0.4689135 1.770405 ] [ 0.1075881 2.160004 0.6716672 ] [ 0.5668509 2.899878 2.242644 ] [ 2.824031 1.222886 2.646945 ] [ 2.932592 2.399832 0.52394 ] [ 1.820297 2.092873 2.325497 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26541e-10 4.689135e-11 1.770405e-10 ] [ 1.075881e-11 2.160004e-10 6.716672e-11 ] [ 5.668509000000001e-11 2.899878e-10 2.242644e-10 ] [ 2.824031e-10 1.222886e-10 2.646945e-10 ] [ 2.932592e-10 2.399832e-10 5.2394e-11 ] [ 1.820297e-10 2.092873e-10 2.325497e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.6147627 -20.8664819 -6.1445098 ] [ -0.0671497 -3.7141617 -5.9725807 ] [ -5.709046 16.0980035 4.7744899 ] [ -24.8053599 24.8388967 -12.4744211 ] [ -1.7337025 -0.3477728 2.3438815 ] [ 35.9300208 -16.0084839 17.4731402 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.791488335394751e-09 -3.343178973396392e-08 -9.84459002894401e-09 ] [ -1.075856803201098e-10 -5.950743090637717e-09 -9.569129242219362e-09 ] [ -9.146900103631163e-09 2.579184506175022e-08 7.649576157048995e-09 ] [ -3.974256802974057e-08 3.97962999070797e-08 -1.998622600909658e-08 ] [ -2.777697635807385e-09 -5.571934541007551e-10 3.755312172164871e-09 ] [ 5.756623978489398e-08 -2.564841885034519e-08 2.799505695104608e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.161098444357378 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.429075767332314e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1153841 0.3838704 1.8646527 ] [ -0.1820043 2.2092152 0.4803957 ] [ 0.4728298 2.9337455 2.226334 ] [ 2.9588175 1.3908082 2.5884925 ] [ 3.0959067 2.457054 0.6582084 ] [ 2.0558352 1.8696932 2.3630148 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1153841e-10 3.838704e-11 1.8646527e-10 ] [ -1.820043e-11 2.2092152e-10 4.803957e-11 ] [ 4.728298e-11 2.9337455e-10 2.226334e-10 ] [ 2.9588175e-10 1.3908082e-10 2.5884925e-10 ] [ 3.0959067e-10 2.457054e-10 6.582084e-11 ] [ 2.0558352e-10 1.8696932e-10 2.3630148e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 239.4078431 165.6000387 235.0231216 ] [ 149.2137947 22.1006822 146.2576008 ] [ -541.9369184 272.6879321 -62.0312723 ] [ 3502.0927022 -1862.1638311 341.387813 ] [ 215.9459156 -109.2260698 228.0723111 ] [ -3564.7233372 1511.0012479 -888.7095742 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.835736522111581e-07 2.653205125946357e-07 3.765485538772607e-07 ] [ 2.39066855338813e-07 3.540919661629971e-08 2.343305105466597e-07 ] [ -8.682786677624445e-07 4.368942331843985e-07 -9.938505505635142e-08 ] [ 5.61097109756676e-06 -2.983515378868342e-06 5.469635771209614e-07 ] [ 3.459835001820561e-07 -1.74999456857213e-07 3.654121277067988e-07 ] [ -5.711316437536342e-06 2.420890893330221e-06 -1.423869714195329e-06 ] ] } "relaxed-potential-energy" { "source-value" -2278.064254055643 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.64986131859859e-16 } }