{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1585989 0.6992287 -1.0303364 ] [ 0.6243354 -2.0495338 0.0335367 ] [ -3.784759 0.956501 2.4178702 ] [ -6.1214263 1.4960352 -0.1250737 ] [ -0.6122652 -3.2209914 1.8374005 ] [ 4.895252 -5.2755232 -8.2359123 ] [ 5.1574621 7.3942835 5.102515 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.541034517581025e-10 1.120287884962196e-09 -1.650780905239677e-09 ] [ 1.000295589659043e-09 -3.283715164953228e-09 5.37317171214678e-11 ] [ -6.063852435121205e-09 1.532483552597634e-09 3.873855138484906e-09 ] [ -9.807606184613074e-09 2.396912641081516e-09 -2.003901596679258e-10 ] [ -9.809569972513367e-10 -5.160597159394947e-09 2.943840148399916e-09 ] [ 7.843058371941767e-09 -8.452320003164908e-09 -1.31953862467332e-08 ] [ 8.26316526736057e-09 1.184694824887174e-08 8.17513030763451e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.494547 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.80293544258148e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8418473 2.6685374 1.0185496 ] [ 1.4990509 1.3193496 3.0063673 ] [ 1.4234452 3.3844744 4.4408015 ] [ 1.7768703 4.7754137 2.3914709 ] [ 3.6459622 2.1727162 4.0016573 ] [ 3.9993767 3.5636428 1.9523159 ] [ 3.5640354 4.6863789 4.1664308 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8418473e-10 2.6685374e-10 1.0185496e-10 ] [ 1.4990509e-10 1.3193496e-10 3.0063673e-10 ] [ 1.4234452e-10 3.3844744e-10 4.4408015e-10 ] [ 1.7768703e-10 4.7754137e-10 2.3914709e-10 ] [ 3.6459622e-10 2.1727162e-10 4.0016573e-10 ] [ 3.9993767e-10 3.5636428e-10 1.9523159e-10 ] [ 3.5640354e-10 4.686378900000001e-10 4.1664308e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9e-07 -1.2e-05 -2.1e-06 ] [ -3.9e-06 -7.6e-06 -1.84e-05 ] [ -5.8e-06 2.08e-05 1.37e-05 ] [ -3.6e-06 2e-06 1.82e-05 ] [ 8.4e-06 3.5e-06 -6.5e-06 ] [ 1.3e-05 -5.3e-06 6.1e-06 ] [ -7.3e-06 -1.4e-06 -1.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.4419589706e-15 -1.9226119608e-14 -3.364570931399999e-15 ] [ -6.248488872599999e-15 -1.21765424184e-14 -2.94800500656e-14 ] [ -9.2926244772e-15 3.332527398719999e-14 2.19498198858e-14 ] [ -5.767835882399999e-15 3.204353268e-15 2.915961473879999e-14 ] [ 1.34582837256e-14 5.607618218999999e-15 -1.0414148121e-14 ] [ 2.082829624199999e-14 -8.4915361602e-15 9.773277467399999e-15 ] [ -1.16958894282e-14 -2.2430472876e-15 -1.74637253106e-14 ] ] } "relaxed-potential-energy" { "source-value" -25.011241 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.007242591754279e-18 } }