{ "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" [ [ 2.905521 1.741541 1.432593 ] [ 2.475113 5.398899 1.710867 ] [ 1.47054 3.340259 2.516001 ] [ 3.027539 3.458512 0.3041981 ] [ 3.800453 3.660633 2.737021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.905521e-10 1.741541e-10 1.432593e-10 ] [ 2.475113e-10 5.398899000000001e-10 1.710867e-10 ] [ 1.47054e-10 3.340259e-10 2.516001e-10 ] [ 3.027539e-10 3.458512e-10 3.041981e-11 ] [ 3.800453e-10 3.660633e-10 2.737021e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7408344 -16.8215015 7.5531143 ] [ -0.8001848 4.5814769 -0.9996445 ] [ -7.3825412 -1.3325407 3.2892405 ] [ 2.3601631 13.1552256 -13.9415348 ] [ 6.5633973 0.4173396 4.0988245 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.186947555564396e-09 -2.695101643005213e-08 1.210142314569016e-08 ] [ -1.282037378879524e-09 7.34033517791526e-09 -1.601607047011306e-09 ] [ -1.182813491273278e-08 -2.134965555804467e-09 5.269944229288502e-09 ] [ 3.781398140094853e-09 2.107699489766965e-08 -2.233680111462961e-08 ] [ 1.051572170708184e-08 6.686517500540237e-10 6.56704078666225e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4407878 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.717103011893867e-19 } "relaxed-configuration-positions" { "source-value" [ [ 3.3558817 1.8494012 1.3066754 ] [ 2.9433809 5.3169688 1.4385074 ] [ 0.9348598 3.248499 3.2437543 ] [ 3.0428338 3.6362188 -0.3565662 ] [ 3.4022099 3.5487562 3.0683092 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.3558817e-10 1.8494012e-10 1.3066754e-10 ] [ 2.9433809e-10 5.3169688e-10 1.4385074e-10 ] [ 9.348598000000001e-11 3.248499e-10 3.2437543e-10 ] [ 3.0428338e-10 3.6362188e-10 -3.565662e-11 ] [ 3.4022099e-10 3.548756200000001e-10 3.0683092e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.7e-06 -1.4e-05 -1.42e-05 ] [ -2.14e-05 -2.54e-05 4.7e-06 ] [ -1.7e-06 2.48e-05 3.8e-06 ] [ 8.8e-06 1.13e-05 4.2e-06 ] [ 4.6e-06 3.2e-06 1.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.554111322176e-14 -2.24304726912e-14 -2.275090801536e-14 ] [ -3.428657968511999e-14 -4.069528616832e-14 7.53023011776e-15 ] [ -2.72370025536e-15 3.973398019584e-14 6.08827115904e-15 ] [ 1.409915426304e-14 1.810459581504e-14 6.72914180736e-15 ] [ 7.370012455680001e-15 5.126965186560001e-15 2.24304726912e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.027456 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.927010881090069e-18 } }