{ "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" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9931382 -4.5220014 -3.5904853 ] [ 0.0808418 0.5076542 0.571052 ] [ -3.3382199 -0.7355385 -3.451054 ] [ -6.810244 -5.7842145 9.6352288 ] [ 2.0169374 11.2594096 -3.5998914 ] [ 0.7112114 0.9007406 -4.4248995 ] [ 9.3326116 -1.6260501 4.8600493 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.193359426063394e-09 -7.245044922304869e-09 -5.752591604986075e-09 ] [ 1.295228419433894e-10 8.133516906909275e-10 9.149261636610816e-10 ] [ -5.348417878869314e-09 -1.178462588398301e-09 -5.529198035918323e-09 ] [ -1.091121371874348e-08 -9.267333241592362e-09 1.543733831941884e-08 ] [ 3.231489947897138e-09 1.803956282513108e-08 -5.767661838498981e-09 ] [ 1.139486277526437e-09 1.443145530725365e-09 -7.08947052828961e-09 ] [ 1.495249211652688e-08 -2.605219454469502e-09 7.786657364395406e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.058618 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.771785921795805e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8697907 0.7982116 2.7976278 ] [ 2.468488 2.9944227 0.4454822 ] [ 1.0707385 2.6051302 2.4080049 ] [ 2.230971 2.3528802 4.8345908 ] [ 2.6043402 4.4093179 3.4137867 ] [ 4.2408628 2.9992639 2.1330507 ] [ 4.6837617 1.7689066 4.3452104 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8697907e-10 7.982116e-11 2.7976278e-10 ] [ 2.468488e-10 2.9944227e-10 4.454822e-11 ] [ 1.0707385e-10 2.6051302e-10 2.4080049e-10 ] [ 2.230971e-10 2.3528802e-10 4.8345908e-10 ] [ 2.6043402e-10 4.4093179e-10 3.4137867e-10 ] [ 4.240862800000001e-10 2.9992639e-10 2.1330507e-10 ] [ 4.6837617e-10 1.7689066e-10 4.3452104e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.64e-05 -1.41e-05 2.1e-06 ] [ -3.99e-05 5.3e-06 -4.6e-06 ] [ -2.34e-05 1.49e-05 -5.56e-05 ] [ -7.1e-06 -1.01e-05 2.82e-05 ] [ 2.29e-05 4e-07 6.1e-06 ] [ 1.26e-05 -8.3e-06 5.4e-06 ] [ 1.84e-05 1.19e-05 1.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.627569658112e-14 -2.259069035328e-14 3.36457090368e-15 ] [ -6.392684716992e-14 8.491536090240001e-15 -7.370012455680001e-15 ] [ -3.749093292672001e-14 2.387243164992e-14 -8.908102011648e-14 ] [ -1.137545400768e-14 -1.618198387008e-14 4.518138070656001e-14 ] [ 3.668984461632e-14 6.408706483200001e-16 9.77327738688e-15 ] [ 2.018742542208e-14 -1.329806595264e-14 8.65175375232e-15 ] [ 2.948004982272e-14 1.906590178752e-14 2.931983216064e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.543705 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.650593737241206e-18 } }