{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4988731 -4.1857073 -10.9656453 ] [ 1.2020218 -8.1668509 7.4135109 ] [ -1.8383454 6.3522781 -2.6079816 ] [ -10.2796234 2.0069988 0.3135241 ] [ 10.4170738 3.9932813 5.8465919 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.992828175660205e-10 -6.706242377571892e-09 -1.756890053164541e-08 ] [ 1.925851225651934e-09 -1.308473757753944e-08 1.187775384202597e-08 ] [ -2.945354020835224e-09 1.017747146063985e-08 -4.178447146996577e-09 ] [ -1.646977228210861e-08 3.215566555333655e-09 5.023209830773612e-10 ] [ 1.668999209950822e-08 6.397941939137831e-09 9.367272853538651e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.2802712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.006210368892356e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2082251 1.7927371 0.5541746 ] [ 2.2266391 1.9047798 4.3193716 ] [ 1.8338932 5.0947507 2.5370155 ] [ 0.6997749 2.8876003 2.6257466 ] [ 3.4781153 4.1659152 4.3013967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2082251e-10 1.7927371e-10 5.541746e-11 ] [ 2.2266391e-10 1.9047798e-10 4.3193716e-10 ] [ 1.8338932e-10 5.094750699999999e-10 2.5370155e-10 ] [ 6.997749e-11 2.8876003e-10 2.6257466e-10 ] [ 3.4781153e-10 4.1659152e-10 4.3013967e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.51e-05 -2.4e-06 -6.4e-06 ] [ 9.8e-06 -3.2e-06 -8e-06 ] [ 1.14e-05 7.9e-06 -1.08e-05 ] [ -2.16e-05 5.9e-06 2.97e-05 ] [ -1.47e-05 -8.1e-06 -4.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.419286697408e-14 -3.84522388992e-15 -1.025393037312e-14 ] [ 1.570133088384e-14 -5.126965186560001e-15 -1.28174129664e-14 ] [ 1.826481347712e-14 1.265719530432e-14 -1.730350750464e-14 ] [ -3.460701500928e-14 9.45284206272e-15 4.758464563776e-14 ] [ -2.355199632576e-14 -1.297763062848e-14 -7.2097947936e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }