{ "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" [ [ 3.052782 0.533749 2.863364 ] [ 2.918449 2.894241 2.581593 ] [ 2.15775 1.828991 4.761683 ] [ 4.980199 1.864144 2.667187 ] [ 4.882978 3.954202 1.645371 ] [ 4.390119 4.230009 4.149708 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.052782e-10 5.33749e-11 2.863364e-10 ] [ 2.918449e-10 2.894241e-10 2.581593e-10 ] [ 2.15775e-10 1.828991e-10 4.761683e-10 ] [ 4.980199e-10 1.864144e-10 2.667187e-10 ] [ 4.882978e-10 3.954202e-10 1.645371e-10 ] [ 4.390119000000001e-10 4.230009e-10 4.149708000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2314041 -0.7448493 0.9645043 ] [ -3.2644756 2.3041761 0.9304168 ] [ 0.3337864 -0.3631147 -1.2290361 ] [ 2.6843171 -1.5525363 0.3507254 ] [ 0.4860644 0.8726217 0.2692401 ] [ -0.0082882 -0.5162974 -1.2858505 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.707502389772653e-10 -1.193380134479246e-09 1.545306240121069e-09 ] [ -5.230266485492053e-09 3.691697077626123e-09 1.49069204455955e-09 ] [ 5.347847664209972e-10 -5.817738830088057e-10 -1.969132905539211e-09 ] [ 4.300750100433656e-09 -2.487437362803335e-09 5.619240362007283e-10 ] [ 7.787610178831796e-10 1.398094086542751e-09 4.31370193601854e-10 ] [ -1.327916026851456e-11 -8.271996236598259e-10 -2.06015960894399e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.943709 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.394246118783855e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.3546491 0.4183681 2.7821233 ] [ 2.030406 3.8041005 3.6919519 ] [ 2.1240139 1.6120639 4.2671207 ] [ 5.4303327 1.2976384 2.5310967 ] [ 5.3368438 3.4896847 1.9559112 ] [ 4.1060315 4.6834803 3.4407023 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3546491e-10 4.183681e-11 2.7821233e-10 ] [ 2.030406e-10 3.8041005e-10 3.6919519e-10 ] [ 2.1240139e-10 1.6120639e-10 4.2671207e-10 ] [ 5.4303327e-10 1.2976384e-10 2.5310967e-10 ] [ 5.336843799999999e-10 3.4896847e-10 1.9559112e-10 ] [ 4.1060315e-10 4.683480300000001e-10 3.4407023e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.57e-05 -1.86e-05 5.16e-05 ] [ 4.64e-05 6.09e-05 -5.26e-05 ] [ -5.78e-05 -2.63e-05 2.9e-06 ] [ 3.03e-05 7.14e-05 -5.46e-05 ] [ -4.48e-05 -4.55e-05 -5.2e-06 ] [ 3e-07 -4.19e-05 5.8e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.117593915456e-14 -2.980048514688e-14 8.267231363328e-14 ] [ 7.434099520512001e-14 9.757255620672e-14 -8.427449025408001e-14 ] [ -9.260580868224001e-14 -4.213724512704e-14 4.646312200320001e-15 ] [ 4.854595161024e-14 1.1439541072512e-13 -8.747884349568e-14 ] [ -7.177751261183999e-14 -7.28990362464e-14 -8.33131842816e-15 ] [ 4.8065298624e-16 -6.713120041152e-14 9.29262440064e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.140193 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.906379312139982e-18 } }