{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.2850513 -1.2408505 -6.44042 ] [ -3.0686083 -3.9092709 5.28901 ] [ 6.9444886 -5.7135672 -2.8582322 ] [ 0.3665523 6.1571451 9.9689055 ] [ 2.8678434 -0.2120376 0.5650537 ] [ -0.884049 5.036778 -6.4714365 ] [ 0.0588243 -0.1181969 -0.0528803 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.006976225338865e-08 -1.988061661007991e-09 -1.031869035213274e-08 ] [ -4.916452476652833e-09 -6.263342440353776e-09 8.47392816917741e-09 ] [ 1.112629727833212e-08 -9.154143789209717e-09 -4.57939280765775e-09 ] [ 5.872815253604678e-10 9.864833930093278e-09 1.597194732706453e-08 ] [ 4.594791647595583e-09 -3.397216854505421e-10 9.05315827636537e-10 ] [ -1.416402639441619e-09 8.069807955759782e-09 -1.036838426329178e-08 ] [ 9.424691819492545e-11 -1.893723098310355e-10 -8.472358036089025e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -10.108072 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.61949166397631e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.483323 2.0834351 1.5908191 ] [ 2.364626 0.7670634 3.306035 ] [ 4.8248801 1.3221999 3.2963731 ] [ 3.1793528 2.8749982 4.4477942 ] [ 5.3124798 3.193888 1.8243075 ] [ 2.9766238 3.8310814 1.1585399 ] [ 3.9700465 4.8523916 3.1931822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.483323e-10 2.0834351e-10 1.5908191e-10 ] [ 2.364626e-10 7.670633999999999e-11 3.306035e-10 ] [ 4.8248801e-10 1.3221999e-10 3.2963731e-10 ] [ 3.179352800000001e-10 2.8749982e-10 4.4477942e-10 ] [ 5.3124798e-10 3.193888e-10 1.8243075e-10 ] [ 2.9766238e-10 3.8310814e-10 1.1585399e-10 ] [ 3.9700465e-10 4.8523916e-10 3.1931822e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.86e-05 4.92e-05 1.3e-05 ] [ 1.35e-05 -3.21e-05 9.3e-06 ] [ 2.09e-05 -4.21e-05 5.56e-05 ] [ 5.5e-06 -4.87e-05 1.35e-05 ] [ 1.86e-05 2.4e-05 -3e-07 ] [ -2.5e-06 2.51e-05 -6.35e-05 ] [ -1.74e-05 2.46e-05 -2.77e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.184401756288e-14 7.882708974336e-14 2.08282960704e-14 ] [ 2.16293843808e-14 -5.142986952768e-14 1.490024257344e-14 ] [ 3.348549137472e-14 -6.745163573568001e-14 8.908102011648e-14 ] [ 8.8119714144e-15 -7.802600143296e-14 2.16293843808e-14 ] [ 2.980048514688e-14 3.84522388992e-14 -4.8065298624e-16 ] [ -4.005441552e-15 4.021463318208e-14 -1.017382154208e-13 ] [ -2.787787320192e-14 3.941354487168e-14 -4.438029239616e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.065695 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.894443416750346e-18 } }