{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.6834159 -10.9203347 -27.6149034 ] [ -12.3606234 10.2421134 20.6909393 ] [ -0.1299076 -0.279184 -0.2135786 ] [ 0.2797268 -0.5264577 -0.1142758 ] [ 8.5273883 1.483863 7.2518185 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.90148283966299e-09 -1.749630494765098e-08 -4.424395261313043e-08 ] [ -1.980390182999341e-08 1.64096746370624e-08 3.315053920885192e-08 ] [ -2.081349195842381e-10 -4.473020777014272e-10 -3.421906396231949e-10 ] [ 4.481717391711975e-10 -8.434782187801402e-10 -1.830900150832166e-10 ] [ 1.366238217074346e-08 2.37741060707015e-09 1.161869405898492e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.7672135 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.831388153662141e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2178381 1.8365477 -0.2791767 ] [ 0.1467255 3.3485349 1.4957899 ] [ 1.8397111 0.2315189 0.2056545 ] [ 2.7711495 0.7516843 2.2801388 ] [ 1.725151 2.6783677 3.0772791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.178381e-11 1.8365477e-10 -2.791767e-11 ] [ 1.467255e-11 3.3485349e-10 1.4957899e-10 ] [ 1.8397111e-10 2.315189e-11 2.056545e-11 ] [ 2.7711495e-10 7.516843e-11 2.2801388e-10 ] [ 1.725151e-10 2.6783677e-10 3.0772791e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.03e-05 1.36e-05 2.33e-05 ] [ 1.77e-05 -8.4e-06 -2.03e-05 ] [ -9e-06 -1.15e-05 -2.7e-05 ] [ 1.89e-05 1.4e-05 2.25e-05 ] [ -1.73e-05 -7.8e-06 1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.650241919424e-14 2.178960204288e-14 3.733071526464e-14 ] [ 2.835852618816e-14 -1.345828361472e-14 -3.252418540224e-14 ] [ -1.44195895872e-14 -1.84250311392e-14 -4.32587687616e-14 ] [ 3.028113813312e-14 2.24304726912e-14 3.604897396800001e-14 ] [ -2.771765553984e-14 -1.249697764224e-14 2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.4797183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.198382979042992e-18 } }