{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.7258123e-10 2.1184321e-10 1.9729612e-10 ] [ 2.6312591e-10 2.0978408e-10 4.3660507e-10 ] [ 1.8049453e-10 3.9998605e-10 3.1676283e-10 ] [ 4.9944527e-10 2.716024e-10 2.0600161e-10 ] [ 4.736557000000001e-10 3.1259132e-10 4.365398199999999e-10 ] [ 5.1870986e-10 5.0159451e-10 1.7177146e-10 ] [ 3.807631e-10 5.1490063e-10 3.5953869e-10 ] ] "source-value" [ [ 2.7258123 2.1184321 1.9729612 ] [ 2.6312591 2.0978408 4.3660507 ] [ 1.8049453 3.9998605 3.1676283 ] [ 4.9944527 2.716024 2.0600161 ] [ 4.736557 3.1259132 4.3653982 ] [ 5.1870986 5.0159451 1.7177146 ] [ 3.807631 5.1490063 3.5953869 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.64896017812736e-12 -5.30352505017216e-12 5.33941380647808e-12 ] [ -2.09853093792384e-12 2.80364886873792e-12 -1.64559560722368e-12 ] [ 7.784495547480959e-12 -6.608978560800001e-13 -7.6279628916288e-13 ] [ -9.93349504896e-14 -1.60810467429696e-12 -1.98013008564672e-12 ] [ -5.62748516289792e-12 -5.133854546029441e-12 -2.48866094508864e-12 ] [ -4.2201332191872e-13 5.11607038553856e-12 -2.92589494490496e-12 ] [ -1.18609135237824e-12 4.78650265464e-12 4.46350384788672e-12 ] ] "source-value" [ [ 0.0010292 -0.0033102 0.0033326 ] [ -0.0013098 0.0017499 -0.0010271 ] [ 0.0048587 -0.0004125 -0.0004761 ] [ -6.2e-05 -0.0010037 -0.0012359 ] [ -0.0035124 -0.0032043 -0.0015533 ] [ -0.0002634 0.0031932 -0.0018262 ] [ -0.0007403 0.0029875 0.0027859 ] ] } "species" { "source-value" [ "Si" "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" -3.619187370298578e-18 "source-value" -22.589191 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.991976559412194e-18 "source-value" -18.674449 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "instance-id" 1 }