{ "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" [ [ 1.93515 2.579075 2.191315 ] [ 2.854208 3.00929 4.274511 ] [ 2.977973 4.356331 0.9884451 ] [ 4.176928 2.41177 1.411978 ] [ 5.404797 4.627409 0.9176814 ] [ 4.282265 4.172591 2.948671 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.93515e-10 2.579075e-10 2.191315e-10 ] [ 2.854208e-10 3.00929e-10 4.274511e-10 ] [ 2.977973e-10 4.356331e-10 9.884451e-11 ] [ 4.176928e-10 2.41177e-10 1.411978e-10 ] [ 5.404797000000001e-10 4.627409e-10 9.176814e-11 ] [ 4.282265e-10 4.172591e-10 2.948671e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -9.2411141 -5.482216 -0.1311472 ] [ -1.8678669 -0.5287773 4.3544988 ] [ -8.0449442 7.0302809 -6.7568399 ] [ 4.6658203 -12.2050284 -4.4988451 ] [ 7.1987212 4.2229465 -4.342295 ] [ 7.2893837 6.9627943 11.3746284 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.480589696116523e-08 -8.783478305375695e-09 -2.101209777233817e-10 ] [ -2.992652677946172e-09 -8.471946276697478e-10 6.976676172661655e-09 ] [ -1.288942151288056e-08 1.126375169563678e-08 -1.082565091826861e-08 ] [ 7.475468201514043e-09 -1.955461115868003e-08 -7.207944439820637e-09 ] [ 1.153362280629732e-08 6.765906153189187e-09 -6.957123529616736e-09 ] [ 1.16788801441806e-08 1.11556262428995e-08 1.822416369276771e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.2200572 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.95474712187871e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1512604 2.5275287 1.9275099 ] [ 2.8291662 3.2591197 4.1008188 ] [ 2.5249376 4.6777023 0.7663476 ] [ 4.3978166 1.8810448 1.1236314 ] [ 4.9249468 4.2944154 1.2182573 ] [ 4.8031934 4.5166552 3.5960365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1512604e-10 2.5275287e-10 1.9275099e-10 ] [ 2.8291662e-10 3.2591197e-10 4.1008188e-10 ] [ 2.5249376e-10 4.6777023e-10 7.663476e-11 ] [ 4.3978166e-10 1.8810448e-10 1.1236314e-10 ] [ 4.9249468e-10 4.2944154e-10 1.2182573e-10 ] [ 4.8031934e-10 4.5166552e-10 3.5960365e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.47e-05 -1e-07 6.9e-06 ] [ -1.35e-05 1.43e-05 1e-06 ] [ 4.3e-06 -1.37e-05 6.1e-06 ] [ -4.2e-06 9e-06 -1.34e-05 ] [ -1.8e-06 1.3e-06 1.5e-06 ] [ 5e-07 -1.08e-05 -2.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.355199632576e-14 -1.6021766208e-16 1.105501868352e-14 ] [ -2.16293843808e-14 2.291112567744e-14 1.6021766208e-15 ] [ 6.889359469440001e-15 -2.194981970496e-14 9.77327738688e-15 ] [ -6.72914180736e-15 1.44195895872e-14 -2.146916671872e-14 ] [ -2.88391791744e-15 2.08282960704e-15 2.4032649312e-15 ] [ 8.010883104e-16 -1.730350750464e-14 -3.52478856576e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.9625962 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.435966209331092e-18 } }