{ "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" [ [ 0.099853 0.7165901 0.5986145 ] [ 0.2043706 1.471965 2.579922 ] [ 1.736021 0.3195483 2.600696 ] [ 1.725047 2.389347 1.166635 ] [ 1.83697 2.73027 2.853175 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.9853e-12 7.165901e-11 5.986145000000001e-11 ] [ 2.043706e-11 1.471965e-10 2.579922e-10 ] [ 1.736021e-10 3.195483e-11 2.600696e-10 ] [ 1.725047e-10 2.389347e-10 1.166635e-10 ] [ 1.83697e-10 2.73027e-10 2.853175e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4477937 -1.0676339 -1.5596177 ] [ -15.1331018 6.1663632 3.7391072 ] [ 9.0587631 -3.5603183 -2.8305991 ] [ -2.3854872 -8.4100735 -30.9321423 ] [ 6.0120322 6.8716625 31.5832519 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.921797838681529e-09 -1.710538074153525e-09 -2.498783016325868e-09 ] [ -2.42459019041464e-08 9.879602954401474e-09 5.99071013850495e-09 ] [ 1.451373845218573e-08 -5.704258742866401e-09 -4.535119700877522e-09 ] [ -3.821971821057654e-09 -1.347442314090963e-08 -4.955875522431874e-08 ] [ 9.63233743433679e-09 1.100961700352808e-08 5.060194780301718e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -11.246149 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.80183170018333e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.23092 0.440958 0.6524559 ] [ -0.0804287 1.7958243 2.55267 ] [ 1.851715 0.443148 2.3602134 ] [ 1.5900702 2.33766 0.9665421 ] [ 2.0099849 2.61013 3.2671611 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3092e-11 4.40958e-11 6.524559e-11 ] [ -8.042870000000001e-12 1.7958243e-10 2.55267e-10 ] [ 1.851715e-10 4.43148e-11 2.3602134e-10 ] [ 1.5900702e-10 2.33766e-10 9.665421e-11 ] [ 2.0099849e-10 2.61013e-10 3.2671611e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.3e-06 3.5e-06 1.6e-06 ] [ 3e-06 7.4e-06 5.7e-06 ] [ 3e-06 -6.9e-06 -1.6e-06 ] [ -2e-06 -1.6e-06 -1.2e-06 ] [ -9.3e-06 -2.4e-06 -4.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.491536090240001e-15 5.6076181728e-15 2.56348259328e-15 ] [ 4.8065298624e-15 1.185610699392e-14 9.13240673856e-15 ] [ 4.8065298624e-15 -1.105501868352e-14 -2.56348259328e-15 ] [ -3.2043532416e-15 -2.56348259328e-15 -1.92261194496e-15 ] [ -1.490024257344e-14 -3.84522388992e-15 -7.2097947936e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.398784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.268245481754911e-18 } }