{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.735268 2.856882 0.3239211 ] [ 1.752307 5.080999 1.048158 ] [ 2.257155 3.165316 3.087528 ] [ 4.821596 2.368521 1.002197 ] [ 4.597336 2.893151 3.290106 ] [ 3.849033 4.748793 0.5493667 ] [ 3.5339 4.902962 2.909562 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.735268e-10 2.856882e-10 3.239211e-11 ] [ 1.752307e-10 5.080999e-10 1.048158e-10 ] [ 2.257155e-10 3.165316e-10 3.087528e-10 ] [ 4.821596000000001e-10 2.368521e-10 1.002197e-10 ] [ 4.597336e-10 2.893151e-10 3.290106e-10 ] [ 3.849033e-10 4.748793e-10 5.493667e-11 ] [ 3.5339e-10 4.902962e-10 2.909562e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1839815 -1.0252405 0.4416155 ] [ -1.1048628 -0.5735954 0.6127568 ] [ -1.1117332 -1.937589 -0.4904559 ] [ 0.5106431 0.3549491 0.1012368 ] [ -0.1665114 -0.3514424 0.0508156 ] [ 3.1341619 1.152287 -0.936308 ] [ 0.922284 2.3806313 0.2203392 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.499124099559715e-09 -1.642616359797302e-09 7.075460294829024e-10 ] [ -1.770185347351626e-09 -9.190011396784243e-10 9.817446191962214e-10 ] [ -1.781192941607171e-09 -3.104359796519251e-09 -7.857969765134228e-10 ] [ 8.181404363928365e-10 5.686911495940013e-10 1.621992341246055e-10 ] [ -2.667806721766772e-10 -5.630727968378418e-10 8.141556629192449e-11 ] [ 5.021480921982108e-09 1.84616729185177e-09 -1.500130787468006e-09 ] [ 1.477661862537907e-09 3.814191811604711e-09 3.530223148857754e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.750129158928928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.08148991258163e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4626597 2.8501499 0.2269265 ] [ 1.8158119 4.8914923 1.4459607 ] [ 2.2954773 2.8340167 2.6555184 ] [ 4.6386788 2.7473777 1.3135284 ] [ 4.4516202 2.8954867 3.6968286 ] [ 3.9529047 4.8124582 0.2219806 ] [ 3.9294424 4.9856424 2.6500956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4626597e-10 2.8501499e-10 2.269265e-11 ] [ 1.8158119e-10 4.891492300000001e-10 1.4459607e-10 ] [ 2.2954773e-10 2.8340167e-10 2.6555184e-10 ] [ 4.6386788e-10 2.7473777e-10 1.3135284e-10 ] [ 4.4516202e-10 2.8954867e-10 3.6968286e-10 ] [ 3.9529047e-10 4.812458200000001e-10 2.219806e-11 ] [ 3.9294424e-10 4.9856424e-10 2.650095600000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.73e-05 1.29e-05 7.1e-06 ] [ -3.32e-05 -3.1e-06 -3.36e-05 ] [ -3.1e-06 5.5e-06 1.11e-05 ] [ -2.49e-05 1.01e-05 -1.77e-05 ] [ 1.49e-05 -1.6e-05 2.21e-05 ] [ -7.9e-06 -5.2e-06 1.52e-05 ] [ 2.69e-05 -4.1e-06 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.373942174784e-14 2.066807840832e-14 1.137545400768e-14 ] [ -5.319226381056e-14 -4.96674752448e-15 -5.383313445888e-14 ] [ -4.96674752448e-15 8.8119714144e-15 1.778416049088e-14 ] [ -3.989419785791999e-14 1.618198387008e-14 -2.835852618816e-14 ] [ 2.387243164992e-14 -2.56348259328e-14 3.540810331968e-14 ] [ -1.265719530432e-14 -8.33131842816e-15 2.435308463616e-14 ] [ 4.309855109952001e-14 -6.568924145279999e-15 -6.72914180736e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.101010158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.297924908149922e-18 } }