{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.198213 1.350624 3.055818 ] [ 2.6169 3.019665 1.923407 ] [ 3.04509 0.4771157 2.258597 ] [ 0.8976629 3.617369 3.27072 ] [ 3.817629 1.77083 3.542328 ] [ 3.146341 4.405242 3.880584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.198213e-10 1.350624e-10 3.055818e-10 ] [ 2.6169e-10 3.019665e-10 1.923407e-10 ] [ 3.04509e-10 4.771157e-11 2.258597e-10 ] [ 8.976629000000001e-11 3.617369e-10 3.27072e-10 ] [ 3.817629e-10 1.77083e-10 3.542328e-10 ] [ 3.146341e-10 4.405242e-10 3.880584e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -42.3984979 -32.3337225 5.1142818 ] [ -25.9287172 -1.9075033 -193.6555628 ] [ -54.2105863 -119.4427954 -83.83504 ] [ -39.4783069 9.413484 16.9487428 ] [ 70.6177007 251.0476951 165.1933264 ] [ 91.3984076 -106.7771579 90.2342518 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.79298820924179e-08 -5.180433425293493e-08 8.193982732142941e-09 ] [ -4.154238450517484e-08 -3.056157191358848e-09 -3.102704152060262e-07 ] [ -8.685493396972079e-08 -1.913684543128778e-07 -1.343185410918329e-07 ] [ -6.325122034394733e-08 1.508206398507487e-08 2.715487946611234e-08 ] [ 1.131420290761918e-07 4.022227477949467e-07 2.646688854702634e-07 ] [ 1.46436391835069e-07 -1.7107586602285e-07 1.445712086293403e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 59.078159 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.465364514970511e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5711744 0.9280651 3.2986454 ] [ 2.6799959 3.2330818 1.2385219 ] [ 3.0576511 0.6381358 2.0589657 ] [ 0.601518 3.7344357 3.2617285 ] [ 4.4660109 1.7755922 4.1864407 ] [ 3.3454855 4.3315352 3.8871517 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.711744e-11 9.280651e-11 3.2986454e-10 ] [ 2.6799959e-10 3.2330818e-10 1.2385219e-10 ] [ 3.057651100000001e-10 6.381358000000001e-11 2.0589657e-10 ] [ 6.01518e-11 3.7344357e-10 3.2617285e-10 ] [ 4.4660109e-10 1.7755922e-10 4.186440700000001e-10 ] [ 3.3454855e-10 4.331535200000001e-10 3.8871517e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.5e-06 5.6e-06 -2.6e-06 ] [ -1.02e-05 -1.91e-05 3.61e-05 ] [ 9.3e-06 -1.35e-05 -1.83e-05 ] [ -1.8e-06 1.87e-05 -1.51e-05 ] [ 1.95e-05 9.9e-06 -6.7e-06 ] [ -7.2e-06 -1.6e-06 6.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.52206778976e-14 8.972189076479999e-15 -4.16565921408e-15 ] [ -1.634220153216e-14 -3.060157345728e-14 5.783857601088001e-14 ] [ 1.490024257344e-14 -2.16293843808e-14 -2.931983216064e-14 ] [ -2.88391791744e-15 2.996070280896e-14 -2.419286697408e-14 ] [ 3.12424441056e-14 1.586154854592e-14 -1.073458335936e-14 ] [ -1.153567166976e-14 -2.56348259328e-15 1.073458335936e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.691321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.514026765566808e-18 } }