{ "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" [ [ 2.930378 5.180054 2.851976 ] [ 5.738994 3.052967 1.218676 ] [ 3.217774 2.94037 2.40806 ] [ 5.439965 2.572298 3.526756 ] [ 4.050256 4.656384 1.057411 ] [ 5.133306 4.977378 3.451883 ] [ 3.497867 4.079859 4.731393 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.930378e-10 5.180054e-10 2.851976e-10 ] [ 5.738994e-10 3.052967000000001e-10 1.218676e-10 ] [ 3.217774e-10 2.94037e-10 2.40806e-10 ] [ 5.439965e-10 2.572298e-10 3.526756e-10 ] [ 4.050256e-10 4.656384e-10 1.057411e-10 ] [ 5.133306e-10 4.977378e-10 3.451883e-10 ] [ 3.497867e-10 4.079859e-10 4.731393e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1837218 3.6887372 1.0456356 ] [ 0.3958226 -0.3346121 0.0191473 ] [ -0.6894524 -3.2939161 0.1838868 ] [ -0.4724056 0.3992048 -0.519296 ] [ 1.9342247 0.0094549 -3.9089457 ] [ 3.6159542 1.2162171 0.4159473 ] [ -0.6004217 -1.6850859 2.7636246 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.703061255891293e-09 5.910008502115254e-09 1.675292912196181e-09 ] [ 6.341777157042702e-10 -5.361076836567917e-10 3.067735641144384e-11 ] [ -1.10462451643445e-09 -5.277435366296716e-09 2.946191318337254e-10 ] [ -7.568772078549964e-10 6.395965974711399e-10 -8.320039104749567e-10 ] [ 3.098969593713894e-09 1.514841973200192e-11 -6.262821412516691e-09 ] [ 5.793397281123567e-09 1.948594603437175e-09 6.664210395448839e-10 ] [ -9.619816103609913e-10 -2.699805233019727e-09 4.427814722787752e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.547719 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.971672175096796e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.3125257 5.4871674 2.7878338 ] [ 5.9785344 3.2868819 0.9800332 ] [ 3.0708522 2.7683573 2.6451734 ] [ 5.4070637 2.746617 3.21143 ] [ 3.7541632 4.1047906 0.8238201 ] [ 5.2768378 4.9974257 4.0543511 ] [ 3.2085629 4.0680701 4.7435135 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3125257e-10 5.4871674e-10 2.7878338e-10 ] [ 5.9785344e-10 3.2868819e-10 9.800332000000001e-11 ] [ 3.0708522e-10 2.7683573e-10 2.6451734e-10 ] [ 5.4070637e-10 2.746617e-10 3.21143e-10 ] [ 3.7541632e-10 4.104790600000001e-10 8.238201000000001e-11 ] [ 5.276837800000001e-10 4.9974257e-10 4.0543511e-10 ] [ 3.2085629e-10 4.0680701e-10 4.7435135e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.012829 -0.1137847 -0.7300813 ] [ -0.4999984 0.0543454 0.2094484 ] [ 0.4771609 0.2052603 0.7580703 ] [ 0.2153265 0.200398 -0.4977774 ] [ 0.2013925 0.2807194 0.4768468 ] [ 0.419044 -0.405975 -0.0329651 ] [ -0.8000965 -0.2209635 -0.1835417 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.05543238682432e-11 -1.823031861447418e-10 -1.169719190143271e-09 ] [ -8.010857469174068e-10 8.707092932802432e-11 3.355733297439667e-10 ] [ 7.644960383398867e-10 3.288632538383943e-10 1.214562511582842e-09 ] [ 3.449910841386912e-10 3.210729904550784e-10 -7.975273126426099e-10 ] [ 3.22666355104464e-10 4.497620596850035e-10 7.639927946632935e-10 ] [ 6.713824998865152e-10 -6.5044365362928e-10 -5.281591252233408e-11 ] [ -1.281895906683907e-09 -3.540225537501408e-10 -2.940662206818873e-10 ] ] } "relaxed-potential-energy" { "source-value" -21.501656 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.444945055168405e-18 } }