{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8122987 4.6917525 9.9760247 ] [ -29.0348684 -20.3586214 21.0343378 ] [ 7.5263732 2.4179953 -1.0949761 ] [ 5.0578645 -8.559906 -1.2114974 ] [ 17.2629294 21.8087797 -28.7038889 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.301445986246233e-09 7.517016166079952e-09 1.598335354286333e-08 ] [ -4.65189873384847e-08 -3.261810723879856e-08 3.370072425716971e-08 ] [ 1.205857918045568e-08 3.874055538864282e-09 -1.754345107754763e-09 ] [ 8.103592253074282e-09 -1.371448126944564e-08 -1.941032810439986e-09 ] [ 2.765826189120097e-08 3.494151696351764e-08 -4.598869972162063e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -20.049128 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.212224414902666e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0486533 2.3497968 2.2613041 ] [ 2.3135999 2.2948441 4.468007 ] [ 0.2790867 2.2691267 3.5916991 ] [ 1.4964088 4.1173476 3.4915632 ] [ 3.6266857 3.5722018 3.2222226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0486533e-10 2.3497968e-10 2.2613041e-10 ] [ 2.3135999e-10 2.2948441e-10 4.468007e-10 ] [ 2.790867e-11 2.2691267e-10 3.5916991e-10 ] [ 1.4964088e-10 4.1173476e-10 3.4915632e-10 ] [ 3.6266857e-10 3.5722018e-10 3.2222226e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.05e-05 -5.45e-05 -3.81e-05 ] [ -4.86e-05 1.8e-05 2.87e-05 ] [ 0.0001899 6.28e-05 -4.06e-05 ] [ -0.0001343 6.38e-05 9.6e-05 ] [ -2.75e-05 -9.01e-05 -4.6e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.28446207264e-14 -8.731862583360001e-14 -6.104292925248e-14 ] [ -7.786578377088e-14 2.88391791744e-14 4.598246901696e-14 ] [ 3.0425334028992e-13 1.0061669178624e-13 -6.504837080448e-14 ] [ -2.1517232017344e-13 1.0221886840704e-13 1.538089555968e-13 ] [ -4.4059857072e-14 -1.4435611353408e-13 -7.37001245568e-14 ] ] } "relaxed-potential-energy" { "source-value" -28.867458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.625076630952593e-18 } }