{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.198213 1.350624 3.055818 ] [ 2.6169 3.019665 1.923407 ] [ 3.04509 0.4771157 2.258597 ] [ 0.8976629 3.617369 3.27072 ] [ 3.817629 1.77083 3.542328 ] [ 3.146341 4.405242 3.880584 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.198213e-10 1.350624e-10 3.055818e-10 ] [ 2.6169e-10 3.019665e-10 1.923407e-10 ] [ 3.04509e-10 4.771157e-11 2.258597e-10 ] [ 8.976629000000001e-11 3.617369e-10 3.27072e-10 ] [ 3.817629e-10 1.77083e-10 3.542328e-10 ] [ 3.146341e-10 4.405242e-10 3.880584e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0247249 -1.2372369 0.618343 ] [ 1.0271529 1.2287274 -1.4956412 ] [ -0.6583175 -3.7060778 -3.2000816 ] [ -1.2374578 1.0882803 0.5492393 ] [ 3.6687138 3.0156665 3.5598397 ] [ 0.2246335 -0.3893595 -0.0316993 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.846143519131618e-09 -1.982272035571068e-09 9.906946982353345e-10 ] [ 1.64568036236692e-09 1.96863831361637e-09 -2.396281363745257e-09 ] [ -1.054740907563504e-09 -5.937791206025899e-09 -5.127095924172257e-09 ] [ -1.982625956386602e-09 1.743617253537211e-09 8.799783656845575e-10 ] [ 5.877927478766327e-09 4.831630362429763e-09 5.703491941135686e-09 ] [ 3.599025419484768e-10 -6.238226879863776e-10 -5.078787735572544e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -11.928113 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.911094377886055e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8471029 1.0946635 3.2489155 ] [ 2.6193064 3.2154351 1.5380637 ] [ 2.9223399 1.0415765 2.2489867 ] [ 0.8430131 3.4761366 3.1600543 ] [ 4.1892993 1.8104992 4.0133194 ] [ 3.3007743 4.0025348 3.7221144 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.471029e-11 1.0946635e-10 3.2489155e-10 ] [ 2.6193064e-10 3.2154351e-10 1.5380637e-10 ] [ 2.9223399e-10 1.0415765e-10 2.2489867e-10 ] [ 8.430131e-11 3.4761366e-10 3.1600543e-10 ] [ 4.1892993e-10 1.8104992e-10 4.013319400000001e-10 ] [ 3.3007743e-10 4.0025348e-10 3.7221144e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.8e-06 1.33e-05 2.06e-05 ] [ 2.12e-05 -1.7e-06 1.51e-05 ] [ 7.8e-06 -1.61e-05 -5.4e-06 ] [ 2.57e-05 -2.1e-06 -4.6e-06 ] [ -2.05e-05 7.1e-06 -3.55e-05 ] [ -3.61e-05 -4e-07 9.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.88391791744e-15 2.130894905664e-14 3.300483838848e-14 ] [ 3.396614436096001e-14 -2.72370025536e-15 2.419286697408e-14 ] [ 1.249697764224e-14 -2.579504359488e-14 -8.65175375232e-15 ] [ 4.117593915456e-14 -3.36457090368e-15 -7.370012455680001e-15 ] [ -3.28446207264e-14 1.137545400768e-14 -5.68772700384e-14 ] [ -5.783857601088001e-14 -6.408706483200001e-16 1.570133088384e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.296262 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.290513674123145e-18 } }