{ "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" [ [ 0.0068904 0.1581444 0.9739303 ] [ 1.486449 0.0094288 0.6635661 ] [ 1.283407 0.7092398 2.988588 ] [ 0.3149749 1.776241 2.685574 ] [ 2.9726 1.648627 0.444947 ] [ 2.196005 2.727691 2.654363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.8904e-13 1.581444e-11 9.739303e-11 ] [ 1.486449e-10 9.4288e-13 6.635661000000001e-11 ] [ 1.283407e-10 7.092398e-11 2.988588e-10 ] [ 3.149749e-11 1.776241e-10 2.685574e-10 ] [ 2.9726e-10 1.648627e-10 4.44947e-11 ] [ 2.196005e-10 2.727691e-10 2.654363e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -41.1749238 0.2864331 -0.2307906 ] [ 38.7744395 -11.5845197 -15.6836779 ] [ 29.8659589 -36.4641903 20.3516556 ] [ -38.7139631 36.4742912 -1.8939069 ] [ 2.0904342 3.1377484 -0.603437 ] [ 9.1580544 8.1502373 -1.9398433 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.59695002755815e-08 4.589164162432685e-10 -3.697673036204045e-10 ] [ 6.212350045152404e-08 -1.856044662653703e-08 -2.512802205953764e-08 ] [ 4.785054110735368e-08 -5.842207319506214e-08 3.26069467968934e-08 ] [ -6.20266065773339e-08 5.843825662089118e-08 -3.034373357151803e-09 ] [ 3.349244802560751e-09 5.027227128432607e-09 -9.668126535256898e-10 ] [ 1.467282065169457e-08 1.305811965603212e-08 -3.107971583275521e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 16.374969 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.623559249812476e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.4425232 0.5413994 0.7433105 ] [ 1.8060506 -0.2357395 0.8764415 ] [ 1.8468159 0.2767622 3.2359155 ] [ -0.1536564 1.8976823 2.6852854 ] [ 2.9788221 1.786219 0.4137947 ] [ 2.2248173 2.7630485 2.4562209 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.425232e-11 5.413994e-11 7.433105e-11 ] [ 1.8060506e-10 -2.357395e-11 8.764415e-11 ] [ 1.8468159e-10 2.767622e-11 3.2359155e-10 ] [ -1.536564e-11 1.8976823e-10 2.6852854e-10 ] [ 2.9788221e-10 1.786219e-10 4.137947e-11 ] [ 2.2248173e-10 2.7630485e-10 2.4562209e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.31e-05 -8e-07 -2.22e-05 ] [ -1.68e-05 1.29e-05 -7e-07 ] [ 1.23e-05 7.6e-06 3.12e-05 ] [ 1.29e-05 -1.68e-05 -4.1e-06 ] [ -1.7e-06 7.5e-06 9.9e-06 ] [ 6.4e-06 -1.03e-05 -1.4e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.098851373248e-14 -1.28174129664e-15 -3.556832098176e-14 ] [ -2.691656722944e-14 2.066807840832e-14 -1.12152363456e-15 ] [ 1.970677243584e-14 1.217654231808e-14 4.998791056896e-14 ] [ 2.066807840832e-14 -2.691656722944e-14 -6.568924145279999e-15 ] [ -2.72370025536e-15 1.2016324656e-14 1.586154854592e-14 ] [ 1.025393037312e-14 -1.650241919424e-14 -2.24304726912e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.165535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.269568899812413e-18 } }