{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -17.0737351 -3.0742561 -4.2461898 ] [ 1.952845 -12.7722702 -10.9849657 ] [ -0.8090738 -9.8566235 14.9516817 ] [ -25.8412725 17.5958918 7.0906154 ] [ 19.5562152 -6.9626395 -24.894984 ] [ 3.5071204 21.4969005 -4.1032956 ] [ 18.7079008 -6.427003 22.187138 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.735513920695235e-08 -4.925501249771786e-09 -6.803146025039427e-09 ] [ 3.128802603046176e-09 -2.046343270898054e-08 -1.759985522482991e-08 ] [ -1.296279126861815e-09 -1.579205173172787e-08 2.39552348613832e-08 ] [ -4.140228265122197e-08 2.819172646408643e-08 1.136041822096444e-08 ] [ 3.13325107847736e-08 -1.11553782259586e-08 -3.988616133999006e-08 ] [ 5.619026311210745e-09 3.444183140076383e-08 -6.574204278551509e-09 ] [ 2.997336128600562e-08 -1.029719394841146e-08 3.554771378606327e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.968236 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.077740453221691e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9636846 2.8957224 2.8575251 ] [ 2.5463554 2.379063 1.1790435 ] [ 2.1972323 2.4252936 4.8198448 ] [ 0.9135906 5.2572409 2.7377583 ] [ 4.2595422 3.7741437 2.0203607 ] [ 3.1355566 5.8494422 2.1733626 ] [ 4.4191991 3.0174843 4.2554471 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.636846e-11 2.8957224e-10 2.8575251e-10 ] [ 2.5463554e-10 2.379063e-10 1.1790435e-10 ] [ 2.1972323e-10 2.4252936e-10 4.8198448e-10 ] [ 9.135906000000001e-11 5.2572409e-10 2.7377583e-10 ] [ 4.2595422e-10 3.7741437e-10 2.0203607e-10 ] [ 3.1355566e-10 5.8494422e-10 2.1733626e-10 ] [ 4.4191991e-10 3.0174843e-10 4.2554471e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.5e-06 -1.07e-05 3.02e-05 ] [ -1.06e-05 2.7e-06 2.03e-05 ] [ -1.59e-05 1.02e-05 -5.72e-05 ] [ 2.87e-05 -1.88e-05 -7e-06 ] [ 6.2e-06 -2.48e-05 1.19e-05 ] [ -7.9e-06 1.27e-05 2.1e-05 ] [ -2.1e-06 2.87e-05 -1.91e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.4032649312e-15 -1.714328984256e-14 4.838573394816e-14 ] [ -1.698307218048e-14 4.32587687616e-15 3.252418540224e-14 ] [ -2.547460827072e-14 1.634220153216e-14 -9.164450270976e-14 ] [ 4.598246901696e-14 -3.012092047104e-14 -1.12152363456e-14 ] [ 9.93349504896e-15 -3.973398019584e-14 1.906590178752e-14 ] [ -1.265719530432e-14 2.034764308416e-14 3.36457090368e-14 ] [ -3.36457090368e-15 4.598246901696e-14 -3.060157345728e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.893559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.706646527190543e-18 } }