{ "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" [ [ 0.6618616 0.5532969 2.6678 ] [ 1.355444 2.726321 1.335983 ] [ 0.8455628 2.30582 2.977156 ] [ 2.930365 0.9373095 0.4139469 ] [ 2.829062 1.427351 2.413715 ] [ 2.781652 2.87748 1.992398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.618616000000001e-11 5.532969e-11 2.6678e-10 ] [ 1.355444e-10 2.726321e-10 1.335983e-10 ] [ 8.455628e-11 2.30582e-10 2.977156e-10 ] [ 2.930365e-10 9.373095e-11 4.139469e-11 ] [ 2.829062e-10 1.427351e-10 2.413715e-10 ] [ 2.781652e-10 2.87748e-10 1.992398e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1418185 -11.4317184 -1.8381988 ] [ -17.9231616 1.2687443 -21.1140594 ] [ -6.362567 8.1428184 14.6026975 ] [ 0.0429702 -0.7324994 -3.9897269 ] [ 5.7386774 -27.5418024 12.3020785 ] [ 21.6458996 30.2944573 0.0372091 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.033748147496925e-09 -1.831563195604918e-08 -2.945119141742615e-09 ] [ -2.871607048634032e-08 2.032752455233262e-09 -3.382845234086247e-08 ] [ -1.019395609567359e-08 1.304623326790006e-08 2.339610053511461e-08 ] [ 6.884584983110016e-11 -1.173593413430028e-09 -6.392247162556859e-09 ] [ 9.194374764593331e-09 -4.412683189997333e-08 1.971010255994634e-08 ] [ 3.468055427530407e-08 4.853707122588389e-08 5.961555010100929e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -5.5880222 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.952998525351383e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.791884 0.4490305 2.0609429 ] [ 0.805003 2.6246341 0.870077 ] [ 1.0969438 2.5567768 3.3321403 ] [ 2.7043739 1.052418 0.6015259 ] [ 2.9963106 0.984557 3.0635902 ] [ 3.0094321 3.160162 1.8727226 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.918840000000001e-11 4.490305e-11 2.0609429e-10 ] [ 8.050030000000001e-11 2.6246341e-10 8.70077e-11 ] [ 1.0969438e-10 2.5567768e-10 3.3321403e-10 ] [ 2.704373900000001e-10 1.052418e-10 6.015259e-11 ] [ 2.9963106e-10 9.84557e-11 3.0635902e-10 ] [ 3.0094321e-10 3.160162e-10 1.8727226e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.8e-06 6.1e-06 4.2e-06 ] [ 1.21e-05 1.8e-06 2.6e-06 ] [ -4.7e-06 -1.03e-05 -4.8e-06 ] [ -7.5e-06 -1e-06 6.5e-06 ] [ 9e-07 7.3e-06 -8.3e-06 ] [ -3.6e-06 -3.8e-06 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.48609453824e-15 9.77327738688e-15 6.72914180736e-15 ] [ 1.938633711168e-14 2.88391791744e-15 4.16565921408e-15 ] [ -7.53023011776e-15 -1.650241919424e-14 -7.69044777984e-15 ] [ -1.2016324656e-14 -1.6021766208e-15 1.04141480352e-14 ] [ 1.44195895872e-15 1.169588933184e-14 -1.329806595264e-14 ] [ -5.76783583488e-15 -6.08827115904e-15 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -27.549081 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.413849350272549e-18 } }