{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6024682 -2.2007572 -0.6956075 ] [ 0.3119999 -5.0584242 6.7209732 ] [ -2.113519 5.9244179 -6.8336157 ] [ 0.0497441 1.9466068 2.9899807 ] [ 0.0119833 -0.0531314 -3.2800853 ] [ -0.6647406 -2.1884774 1.1298957 ] [ 1.8020641 1.6297655 -0.031541 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.652604648154586e-10 -3.52600173389727e-09 -1.114486073753136e-09 ] [ 4.99878945471938e-10 -8.104488991328943e-09 1.076818613006336e-08 ] [ -3.386230729416596e-09 9.491963851229032e-09 -1.094865931007183e-08 ] [ 7.969883404273727e-11 3.118807904850302e-09 4.790477174183218e-09 ] [ 1.919936310003264e-11 -8.512588691037312e-11 -5.255275981889755e-09 ] [ -1.065031848216564e-09 -3.50632732542917e-09 1.810292474482451e-09 ] [ 2.887224970202993e-09 2.611172181486422e-09 -5.05342527966528e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -18.674449 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.991976559412194e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7255625 2.1150375 1.9738257 ] [ 2.6301187 2.0985107 4.3667234 ] [ 1.8077436 4.0001005 3.1654699 ] [ 4.9933406 2.7170214 2.0591732 ] [ 4.7360372 3.1250016 4.3649548 ] [ 5.186137 5.0175191 1.7179044 ] [ 3.8088165 5.1498313 3.5971046 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7255625e-10 2.1150375e-10 1.9738257e-10 ] [ 2.6301187e-10 2.0985107e-10 4.3667234e-10 ] [ 1.8077436e-10 4.000100500000001e-10 3.1654699e-10 ] [ 4.9933406e-10 2.7170214e-10 2.0591732e-10 ] [ 4.7360372e-10 3.1250016e-10 4.3649548e-10 ] [ 5.186137000000001e-10 5.017519100000001e-10 1.7179044e-10 ] [ 3.8088165e-10 5.1498313e-10 3.5971046e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.55e-05 3.6e-06 -2.24e-05 ] [ 2.2e-06 2.43e-05 -9.3e-06 ] [ -2.11e-05 -7.5e-06 7.5e-06 ] [ -8.5e-06 -8.5e-06 1.17e-05 ] [ 6.1e-05 -3.6e-06 8.8e-06 ] [ 2.45e-05 -7.6e-06 5.4e-06 ] [ -4.26e-05 -7e-07 -1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.48337376224e-14 5.76783583488e-15 -3.588875630592e-14 ] [ 3.52478856576e-15 3.893289188544e-14 -1.490024257344e-14 ] [ -3.380592669888e-14 -1.2016324656e-14 1.2016324656e-14 ] [ -1.36185012768e-14 -1.36185012768e-14 1.874546646336e-14 ] [ 9.773277386880001e-14 -5.76783583488e-15 1.409915426304e-14 ] [ 3.92533272096e-14 -1.217654231808e-14 8.65175375232e-15 ] [ -6.825272404608e-14 -1.12152363456e-15 -2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -22.589215 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.619191215522467e-18 } }