{ "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" [ [ 1.08267 0.385996 1.67532 ] [ 0.7413004 2.189146 0.0242846 ] [ 0.0452684 1.636125 2.5153 ] [ 2.351375 1.598321 0.2166547 ] [ 2.147702 1.718144 2.949578 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08267e-10 3.85996e-11 1.67532e-10 ] [ 7.413004e-11 2.189146e-10 2.42846e-12 ] [ 4.52684e-12 1.636125e-10 2.5153e-10 ] [ 2.351375e-10 1.598321e-10 2.166547e-11 ] [ 2.147702e-10 1.718144e-10 2.949578e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5503625 -14.9784491 -1.1375674 ] [ -6.7301888 6.6181933 -6.1258134 ] [ -10.3100145 4.3791291 3.780855 ] [ 8.4467727 -0.2019447 -0.4703231 ] [ 9.143793 4.1830713 3.9528488 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.817779377298249e-10 -2.399812116157833e-08 -1.822583907880131e-09 ] [ -1.07829512377685e-08 1.060351466455535e-08 -9.814635093724095e-09 ] [ -1.651846432810119e-08 7.016138321289449e-09 6.05759753754207e-09 ] [ 1.353322185264909e-08 -3.235510797001398e-10 -7.535406812504453e-10 ] [ 1.464997149073276e-08 6.702019095216004e-09 6.333161985094939e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.1929994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.320102299056018e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0659953 0.001837 1.4336409 ] [ 0.2989924 2.0641304 0.0437368 ] [ -0.1085636 2.0500286 2.5283965 ] [ 2.7597207 1.7129031 0.4453506 ] [ 2.352171 1.6988329 2.9300125 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0659953e-10 1.837e-13 1.4336409e-10 ] [ 2.989924e-11 2.0641304e-10 4.37368e-12 ] [ -1.085636e-11 2.0500286e-10 2.5283965e-10 ] [ 2.7597207e-10 1.7129031e-10 4.453506e-11 ] [ 2.352171e-10 1.6988329e-10 2.9300125e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 1.46e-05 -7.7e-06 ] [ 5.7e-06 -1.32e-05 0.0 ] [ 2.38e-05 -6e-07 6e-07 ] [ -1.52e-05 1.3e-06 9e-06 ] [ -1.42e-05 -2.1e-06 -1.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.602176634e-16 2.33917788564e-14 -1.23367600818e-14 ] [ 9.1324068138e-15 -2.11487315688e-14 0.0 ] [ 3.81318038892e-14 -9.613059803999998e-16 9.613059803999998e-16 ] [ -2.43530848368e-14 2.0828296242e-15 1.4419589706e-14 ] [ -2.27509082028e-14 -3.364570931399999e-15 -3.0441356046e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.126158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.423477690979217e-18 } }