{ "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" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -32.4579463 -17.4687624 -21.9161866 ] [ -20.1605252 22.4645226 -1.3140285 ] [ -9.9041739 -24.553295 -13.3760029 ] [ 13.4964635 -21.2088039 -8.4506967 ] [ 20.4728033 -26.8165195 8.816375 ] [ 12.9522064 16.9660022 4.2196288 ] [ 15.6011722 50.616856 32.0209109 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.200336272104187e-08 -2.79880427115901e-08 -3.511360178761024e-08 ] [ -3.230072213848924e-08 3.599213290715323e-08 -2.105305741764893e-09 ] [ -1.586823587091756e-08 -3.933871521260553e-08 -2.1430719126133e-08 ] [ 2.162371828318054e-08 -3.398024976371186e-08 -1.353950868221171e-08 ] [ 3.280104680949708e-08 -4.296480059412731e-08 1.41253899052056e-08 ] [ 2.075172228185613e-08 2.718253207328136e-08 6.760590611814359e-09 ] [ 2.49958333559149e-08 8.10971433016002e-08 5.130315482069989e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.721003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.518782346212666e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5820849 2.2310365 3.849466 ] [ 1.8861745 4.9714274 2.8707132 ] [ 2.8061994 2.7275649 1.233992 ] [ 5.263855 1.9801807 2.3735433 ] [ 4.1375816 1.5233408 4.7799633 ] [ 4.7846014 4.7440364 2.5427457 ] [ 3.5604803 4.2475043 5.1582405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5820849e-10 2.2310365e-10 3.849466e-10 ] [ 1.8861745e-10 4.9714274e-10 2.8707132e-10 ] [ 2.8061994e-10 2.7275649e-10 1.233992e-10 ] [ 5.263855000000001e-10 1.9801807e-10 2.3735433e-10 ] [ 4.1375816e-10 1.5233408e-10 4.779963300000001e-10 ] [ 4.7846014e-10 4.7440364e-10 2.5427457e-10 ] [ 3.5604803e-10 4.2475043e-10 5.1582405e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.3e-06 -2.91e-05 -6e-07 ] [ -1.42e-05 -6.5e-06 -2.32e-05 ] [ -2.4e-05 -3.55e-05 -1.68e-05 ] [ -3.87e-05 1.95e-05 1.5e-06 ] [ -6.1e-06 -1.71e-05 6e-07 ] [ 5.1e-05 4.43e-05 4.81e-05 ] [ 4.03e-05 2.45e-05 -9.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.329806595264e-14 -4.662333966527999e-14 -9.6130597248e-16 ] [ -2.275090801536e-14 -1.04141480352e-14 -3.717049760256e-14 ] [ -3.84522388992e-14 -5.68772700384e-14 -2.691656722944e-14 ] [ -6.200423522496e-14 3.12424441056e-14 2.4032649312e-15 ] [ -9.77327738688e-15 -2.739722021568e-14 9.6130597248e-16 ] [ 8.17110076608e-14 7.097642430144e-14 7.706469546047999e-14 ] [ 6.456771781824e-14 3.92533272096e-14 -1.538089555968e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.305738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.093120207089015e-18 } }