{ "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" [ [ 37.5716705 -14.9418145 29.5005039 ] [ 44.0977363 -25.7535445 15.2887266 ] [ -11.4106821 20.1440387 57.4120345 ] [ -68.6832753 71.3840883 53.7495521 ] [ -8.02017 57.2826991 -40.2348704 ] [ 43.2021004 -26.2215504 18.1258641 ] [ -36.7573798 -81.8939167 -133.8418108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.01964525754471e-08 -2.393942606146239e-08 4.726501803980586e-08 ] [ 7.065236271215361e-08 -4.126172724057921e-08 2.449524052213426e-08 ] [ -1.828192823862205e-08 3.227430811953174e-08 9.198422018630186e-08 ] [ -1.100427388322493e-07 1.143699183136528e-07 8.611627646258563e-08 ] [ -1.284972897470778e-08 9.177700203047283e-08 -6.446336922689822e-08 ] [ 6.921739580060205e-08 -4.201155535813335e-08 2.904083593207944e-08 ] [ -5.889181504262359e-08 -1.312085198034824e-07 -2.144382219160088e-07 ] ] } "unrelaxed-potential-energy" { "source-value" -2.0718272763671663 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.319433251879334e-19 } "relaxed-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 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 37.5716705 -14.9418145 29.5005039 ] [ 44.0977363 -25.7535445 15.2887266 ] [ -11.4106821 20.1440387 57.4120345 ] [ -68.6832753 71.3840883 53.7495521 ] [ -8.02017 57.2826991 -40.2348704 ] [ 43.2021004 -26.2215504 18.1258641 ] [ -36.7573798 -81.8939167 -133.8418108 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.01964525754471e-08 -2.393942606146239e-08 4.726501803980586e-08 ] [ 7.065236271215361e-08 -4.126172724057921e-08 2.449524052213426e-08 ] [ -1.828192823862205e-08 3.227430811953174e-08 9.198422018630186e-08 ] [ -1.100427388322493e-07 1.143699183136528e-07 8.611627646258563e-08 ] [ -1.284972897470778e-08 9.177700203047283e-08 -6.446336922689822e-08 ] [ 6.921739580060205e-08 -4.201155535813335e-08 2.904083593207944e-08 ] [ -5.889181504262359e-08 -1.312085198034824e-07 -2.144382219160088e-07 ] ] } "relaxed-potential-energy" { "source-value" -2.0718272763671663 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.319433251879334e-19 } }