{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.109941 1.98713 2.733868 ] [ 1.585411 0.9055996 0.7031416 ] [ 2.255239 0.4517476 2.903783 ] [ 2.131264 2.335298 0.7662027 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.109941e-10 1.98713e-10 2.733868e-10 ] [ 1.585411e-10 9.055996e-11 7.031416000000001e-11 ] [ 2.255239e-10 4.517476000000001e-11 2.903783e-10 ] [ 2.131264e-10 2.335298e-10 7.662027e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.1187917 9.7823499 1.8413551 ] [ -17.5553355 -47.3711611 -3.4431839 ] [ 7.2708371 -13.1978304 5.4457624 ] [ 18.4032901 50.7866416 -3.8439336 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.300773835805313e-08 1.567305243539223e-08 2.950176116116733e-09 ] [ -2.812674834013071e-08 -7.589696743986974e-08 -5.516588791144992e-09 ] [ 1.164916531124032e-08 -2.114525548637487e-08 8.72507327159576e-09 ] [ 2.948532138694352e-08 8.136917049085238e-08 -6.158660596567502e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 5.037361 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.070742091222873e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2706108 2.1695895 2.6748959 ] [ 1.7114243 0.5904011 0.8140101 ] [ 2.1139262 -0.005409 3.0676968 ] [ 1.9858937 2.9251936 0.5503925 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2706108e-10 2.1695895e-10 2.6748959e-10 ] [ 1.7114243e-10 5.904011000000001e-11 8.140101e-11 ] [ 2.1139262e-10 -5.408999999999999e-13 3.0676968e-10 ] [ 1.9858937e-10 2.9251936e-10 5.503925e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-05 -8.6e-06 1.5e-05 ] [ -6.1e-06 -1.82e-05 2.13e-05 ] [ 3.9e-06 1.21e-05 -2.34e-05 ] [ 1.52e-05 1.47e-05 -1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.082829624199999e-14 -1.37787190524e-14 2.403264951e-14 ] [ -9.773277467399999e-15 -2.915961473879999e-14 3.41263623042e-14 ] [ 6.248488872599999e-15 1.93863372714e-14 -3.749093323559999e-14 ] [ 2.43530848368e-14 2.35519965198e-14 -2.06680785786e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.547071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.689827071333901e-18 } }