{ "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" [ [ 2.648062 2.256008 1.840542 ] [ 2.082623 2.792532 4.589039 ] [ 1.893054 0.6019814 4.219017 ] [ 3.79314 0.2675402 2.698761 ] [ 5.137376 2.400602 1.294264 ] [ 4.215429 1.396012 4.868853 ] [ 4.085322 3.344134 3.585876 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.648062e-10 2.256008e-10 1.840542e-10 ] [ 2.082623e-10 2.792532e-10 4.589039e-10 ] [ 1.893054e-10 6.019814000000001e-11 4.219017e-10 ] [ 3.79314e-10 2.675402e-11 2.698761000000001e-10 ] [ 5.137376e-10 2.400602e-10 1.294264e-10 ] [ 4.215429000000001e-10 1.396012e-10 4.868853e-10 ] [ 4.085322e-10 3.344134e-10 3.585876e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3578029 -0.0727931 0.5436565 ] [ -0.7409439 1.4900025 0.4508383 ] [ 0.4442207 -1.5225392 -0.1306673 ] [ -0.3130737 0.8352857 0.0468047 ] [ -0.9581302 -0.2192007 0.8666606 ] [ -0.143486 -0.9520151 -0.3292186 ] [ 0.3536102 0.44126 -1.4480742 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.17544006203444e-09 -1.166274029755565e-10 8.710337340459551e-10 ] [ -1.187122993904373e-09 2.387247170433552e-09 7.223225840212167e-10 ] [ 7.117200200154106e-10 -2.439376710491535e-09 -2.093520931630598e-10 ] [ -5.01599362727353e-10 1.338275220228562e-09 7.498939608355776e-11 ] [ -1.535093806122428e-09 -3.511982368029946e-10 1.3885433514885e-09 ] [ -2.298899146121088e-10 -1.525296335868574e-09 -5.274663440525068e-10 ] [ 5.665459953164122e-10 7.06976455694208e-10 -2.320070628423663e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.72368 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.999864235134055e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3489558 2.1377819 1.5788455 ] [ 2.001743 2.9576355 3.7553452 ] [ 2.2263239 0.7483823 4.5290585 ] [ 3.6890383 0.3871644 2.6149277 ] [ 4.6876601 2.465997 1.8306282 ] [ 4.5650237 1.0765928 4.7808634 ] [ 4.3362611 3.2852558 4.0066835 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3489558e-10 2.1377819e-10 1.5788455e-10 ] [ 2.001743e-10 2.9576355e-10 3.7553452e-10 ] [ 2.2263239e-10 7.483823e-11 4.5290585e-10 ] [ 3.6890383e-10 3.871644e-11 2.6149277e-10 ] [ 4.6876601e-10 2.465997e-10 1.8306282e-10 ] [ 4.5650237e-10 1.0765928e-10 4.780863400000001e-10 ] [ 4.3362611e-10 3.2852558e-10 4.006683500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.98e-05 -1.09e-05 -5.8e-06 ] [ -1.72e-05 1.03e-05 9.1e-06 ] [ -2.78e-05 -1.18e-05 4.25e-05 ] [ -8.6e-06 7.3e-06 -1.81e-05 ] [ 2.4e-06 1.28e-05 7.7e-06 ] [ 1.36e-05 6e-06 -1.92e-05 ] [ -2.2e-06 -1.38e-05 -1.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.376662950784e-14 -1.746372516672e-14 -9.292624400640001e-15 ] [ -2.755743787776e-14 1.650241919424e-14 1.457980724928e-14 ] [ -4.454051005824e-14 -1.890568412544e-14 6.8092506384e-14 ] [ -1.377871893888e-14 1.169588933184e-14 -2.899939683648e-14 ] [ 3.84522388992e-15 2.050786074624e-14 1.233675998016e-14 ] [ 2.178960204288e-14 9.6130597248e-15 -3.076179111936e-14 ] [ -3.52478856576e-15 -2.211003736704e-14 -2.611547891904e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.906032 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.669950894569667e-18 } }