{ "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" [ [ -5.200336314948676e-08 -2.798804294217776e-08 -3.51136020769039e-08 ] [ -3.230072240460817e-08 3.599213320368492e-08 -2.105305759110069e-09 ] [ -1.586823600165265e-08 -3.933871553670902e-08 -2.143071930269623e-08 ] [ 2.162371846133386e-08 -3.398025004366807e-08 -1.353950879376091e-08 ] [ 3.280104707973809e-08 -4.296480094810536e-08 1.412539002158175e-08 ] [ 2.075172245282525e-08 2.718253229723259e-08 6.760590667513459e-09 ] [ 2.499583356185037e-08 8.109714396974271e-08 5.13031552433759e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 15.721003 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.51878236696439e-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" [ [ -1.32980660622e-14 -4.66233400494e-14 -9.613059803999998e-16 ] [ -2.27509082028e-14 -1.0414148121e-14 -3.71704979088e-14 ] [ -3.8452239216e-14 -5.6877270507e-14 -2.691656745119999e-14 ] [ -6.200423573579999e-14 3.1242444363e-14 2.403264951e-15 ] [ -9.773277467399999e-15 -2.73972204414e-14 9.613059803999998e-16 ] [ 8.171100833399999e-14 7.09764248862e-14 7.706469609539999e-14 ] [ 6.456771835019998e-14 3.925332753299999e-14 -1.53808956864e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.305738 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.093120232572589e-18 } }