{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.0489832e-10 2.064331e-11 1.113645e-10 ] [ 5.68749e-12 2.3862017e-10 3.295195e-11 ] [ 6.280560000000001e-12 1.8687899e-10 2.6447818e-10 ] [ 2.659765e-10 2.21335e-12 2.8470282e-10 ] [ 2.4139842e-10 2.1624091e-10 4.877867000000001e-11 ] [ 2.3760906e-10 2.3521661e-10 2.8520304e-10 ] ] "source-value" [ [ 1.0489832 0.2064331 1.113645 ] [ 0.0568749 2.3862017 0.3295195 ] [ 0.0628056 1.8687899 2.6447818 ] [ 2.659765 0.0221335 2.8470282 ] [ 2.4139842 2.1624091 0.4877867 ] [ 2.3760906 2.3521661 2.8520304 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.33636967089856e-12 8.84946234732672e-12 6.655441682803199e-12 ] [ 3.67715556239808e-12 -7.37770290345984e-12 -5.331242705712001e-12 ] [ 2.21388765462144e-12 7.800997966675201e-12 -3.16798383230784e-12 ] [ 1.1687878448736e-12 -8.795949648192e-13 -1.69974917700672e-12 ] [ -1.245692322672e-11 4.59680494273728e-12 1.49210708695104e-12 ] [ 6.08827115904e-14 -1.298996738846016e-11 2.05126672761024e-12 ] ] "source-value" [ [ 0.0033307 0.0055234 0.004154 ] [ 0.0022951 -0.0046048 -0.0033275 ] [ 0.0013818 0.004869 -0.0019773 ] [ 0.0007295 -0.000549 -0.0010609 ] [ -0.007775 0.0028691 0.0009313 ] [ 3.8e-05 -0.0081077 0.0012803 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.891382458316307e-18 "source-value" -18.04659 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.31271727860484e-08 -7.556036024112368e-08 1.523537226047767e-08 ] [ -1.96212097955828e-08 7.14689909128146e-08 -1.921179791322199e-08 ] [ -3.224322931219313e-08 -8.609182477546386e-09 3.826624381746795e-09 ] [ -1.404693452043827e-09 8.735537976528115e-10 -3.342804212762797e-09 ] [ -4.247653486567358e-09 5.65035463198322e-10 4.339872690030998e-09 ] [ 3.438961326033872e-08 1.126196254500434e-08 -8.472672062706702e-10 ] ] "source-value" [ [ 14.434846 -47.1610678 9.5091715 ] [ -12.246596 44.6074359 -11.9910612 ] [ -20.124641 -5.3734291 2.3883911 ] [ -0.8767407 0.5452294 -2.0864143 ] [ -2.6511768 0.3526674 2.7087355 ] [ 21.4643085 7.0291642 -0.5288226 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.460165893283667e-19 "source-value" -2.1596657 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.784497e-11 4.697805e-11 1.02237e-10 ] [ 3.714623e-11 2.027429e-10 7.033507e-11 ] [ 1.687176e-11 1.823848e-10 2.813644e-10 ] [ 2.523837e-10 1.233038e-11 2.780688e-10 ] [ 2.720424e-10 2.179791e-10 2.128499e-11 ] [ 1.955613e-10 2.373981e-10 2.741889e-10 ] ] "source-value" [ [ 0.8784497 0.4697805 1.02237 ] [ 0.3714623 2.027429 0.7033507 ] [ 0.1687176 1.823848 2.813644 ] [ 2.523837 0.1233038 2.780688 ] [ 2.720424 2.179791 0.2128499 ] [ 1.955613 2.373981 2.741889 ] ] } "instance-id" 1 }