{ "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" [ [ 2.072399 2.177963 4.557602 ] [ 2.377271 3.879759 3.040396 ] [ 5.261436 0.7705425 2.642102 ] [ 4.650297 3.074511 2.607434 ] [ 3.240336 1.703827 1.872622 ] [ 3.483569 0.4560924 3.818111 ] [ 3.60342 3.885532 5.130911 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.072399e-10 2.177963e-10 4.557602e-10 ] [ 2.377271e-10 3.879759e-10 3.040396e-10 ] [ 5.261436e-10 7.705425e-11 2.642102e-10 ] [ 4.650297000000001e-10 3.074511e-10 2.607434e-10 ] [ 3.240336e-10 1.703827e-10 1.872622e-10 ] [ 3.483569e-10 4.560924000000001e-11 3.818111e-10 ] [ 3.60342e-10 3.885532e-10 5.130911000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2916389 -0.6522484 0.4181729 ] [ 0.4585669 -0.0844988 -0.7486802 ] [ 2.4876645 -0.0740029 -0.7655249 ] [ 2.0771425 3.0631194 1.4693084 ] [ -3.2788387 -0.9772482 -1.6872343 ] [ -1.8841351 -1.1316471 1.892273 ] [ 0.4312387 -0.1434741 -0.5783149 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.672570272958291e-10 -1.045017137434207e-09 6.699868438321364e-10 ] [ 7.347051662527315e-10 -1.35382001845655e-10 -1.199517912895868e-09 ] [ 3.985677902294122e-09 -1.185657162514003e-10 -1.226506097420258e-09 ] [ 3.327949151570064e-09 4.907658289398924e-09 2.354091567225055e-09 ] [ -5.253278708514265e-09 -1.565724218758883e-09 -2.703247349271853e-09 ] [ -3.01871720764867e-09 -1.81309852661612e-09 3.031755560771079e-09 ] [ 6.909205631241849e-10 -2.298708487103213e-10 -9.2656261224029e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.700207 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.636974094272051e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1694352 2.0485033 4.7647817 ] [ 2.374413 3.6676952 3.0092469 ] [ 5.2336542 1.4477343 3.8362659 ] [ 4.6963759 3.2124685 2.3056627 ] [ 2.8930116 1.8007326 1.5981445 ] [ 3.1737551 0.3708854 3.4498521 ] [ 4.148083 3.4002075 4.7052242 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1694352e-10 2.0485033e-10 4.7647817e-10 ] [ 2.374413e-10 3.6676952e-10 3.0092469e-10 ] [ 5.2336542e-10 1.4477343e-10 3.8362659e-10 ] [ 4.6963759e-10 3.2124685e-10 2.3056627e-10 ] [ 2.8930116e-10 1.8007326e-10 1.5981445e-10 ] [ 3.173755100000001e-10 3.708854e-11 3.4498521e-10 ] [ 4.148083e-10 3.4002075e-10 4.7052242e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.6e-06 -3e-07 1.5e-06 ] [ 1e-06 -2e-06 5.7e-06 ] [ 1.09e-05 -6.1e-06 9e-06 ] [ 7e-07 -5e-06 -7.6e-06 ] [ -8.4e-06 1.5e-06 -9.2e-06 ] [ 6.5e-06 1.3e-05 -6e-07 ] [ -5.1e-06 -1e-06 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.972189076479999e-15 -4.8065298624e-16 2.4032649312e-15 ] [ 1.6021766208e-15 -3.2043532416e-15 9.13240673856e-15 ] [ 1.746372516672e-14 -9.77327738688e-15 1.44195895872e-14 ] [ 1.12152363456e-15 -8.010883104e-15 -1.217654231808e-14 ] [ -1.345828361472e-14 2.4032649312e-15 -1.474002491136e-14 ] [ 1.04141480352e-14 2.08282960704e-14 -9.6130597248e-16 ] [ -8.17110076608e-15 -1.6021766208e-15 2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.660576 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.951059832266158e-18 } }