{ "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" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1518661 0.1125061 -1.6239172 ] [ 0.4709276 -0.2100398 2.209676 ] [ 0.3861116 -0.704297 -1.1915254 ] [ -2.9007934 -3.1639524 3.4904249 ] [ 1.789329 3.9208802 -2.6177257 ] [ -1.3959495 -0.1435687 -0.9142906 ] [ 2.8022407 0.1884716 0.6473579 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.845492935712075e-09 1.802546431173869e-10 -2.601802171954998e-09 ] [ 7.545091908094542e-10 -3.365208569975079e-10 3.540291226742861e-09 ] [ 6.186189785396813e-10 -1.128408187499577e-09 -1.909034138969368e-09 ] [ -4.647583367250943e-09 -5.06921056460405e-09 5.592277171438178e-09 ] [ 2.866821090719443e-09 6.281942589397628e-09 -4.194058916207314e-09 ] [ -2.23655765271745e-09 -2.300224146186489e-10 -1.464855023937204e-09 ] [ 4.489684535394227e-09 3.019647912047693e-10 1.037181692670184e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6797990855724585 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.230439454734541e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9119225 1.1556882 2.5857106 ] [ 2.5002559 2.9845413 1.0465557 ] [ 0.9455251 2.5726162 2.6793342 ] [ 2.0659417 2.1448629 4.6324179 ] [ 2.8506343 3.9666336 3.236508 ] [ 4.5815478 2.8113699 1.9905204 ] [ 4.3131258 2.2924209 4.2067069 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9119225e-10 1.1556882e-10 2.5857106e-10 ] [ 2.5002559e-10 2.9845413e-10 1.0465557e-10 ] [ 9.455251e-11 2.5726162e-10 2.6793342e-10 ] [ 2.0659417e-10 2.1448629e-10 4.6324179e-10 ] [ 2.8506343e-10 3.9666336e-10 3.236508e-10 ] [ 4.5815478e-10 2.8113699e-10 1.9905204e-10 ] [ 4.3131258e-10 2.2924209e-10 4.2067069e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.6e-06 1.33e-05 -1.35e-05 ] [ -3.3e-06 -4.5e-06 -6.8e-06 ] [ 1.5e-06 -4.8e-06 7.5e-06 ] [ -8.4e-06 -6.2e-06 6.2e-06 ] [ 6.6e-06 1.45e-05 -1.27e-05 ] [ -1.26e-05 -7.3e-06 1.73e-05 ] [ 9.6e-06 -4.9e-06 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.057436569728e-14 2.130894905664e-14 -2.16293843808e-14 ] [ -5.28718284864e-15 -7.2097947936e-15 -1.089480102144e-14 ] [ 2.4032649312e-15 -7.69044777984e-15 1.2016324656e-14 ] [ -1.345828361472e-14 -9.93349504896e-15 9.93349504896e-15 ] [ 1.057436569728e-14 2.32315610016e-14 -2.034764308416e-14 ] [ -2.018742542208e-14 -1.169588933184e-14 2.771765553984e-14 ] [ 1.538089555968e-14 -7.850665441919999e-15 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }