{ "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" [ [ 2.03068 2.305251 2.057253 ] [ 2.579116 2.417689 4.578894 ] [ 0.1076423 2.252956 3.524492 ] [ 1.371288 4.166573 3.55215 ] [ 3.675708 3.460848 3.322007 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03068e-10 2.305251e-10 2.057253e-10 ] [ 2.579116e-10 2.417689e-10 4.578894e-10 ] [ 1.076423e-11 2.252956e-10 3.524492e-10 ] [ 1.371288e-10 4.166573e-10 3.55215e-10 ] [ 3.675708000000001e-10 3.460848e-10 3.322007e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.4168667 -6.4821183 -10.2903441 ] [ -20.5191969 -19.2994479 26.5122522 ] [ -8.2756873 -6.7954882 1.8617235 ] [ -11.6084222 14.9722681 5.702792 ] [ 38.9864397 17.6047863 -23.7864236 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.270070720232688e-09 -1.03854984790838e-08 -1.648694887283976e-08 ] [ -3.287537782162523e-08 -3.092112447448036e-08 4.247731098955508e-08 ] [ -1.325911282235055e-08 -1.088757241066272e-08 2.982809890668699e-09 ] [ -1.859874280644687e-08 2.398821810780358e-08 9.136880090962126e-09 ] [ 6.246316273018997e-08 2.820597725642331e-08 -3.811005209834616e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.6825626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.297939116962288e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.0757578 2.1905507 1.9389812 ] [ 2.4184548 2.1195053 4.7650881 ] [ -0.0076661 2.1515921 3.625364 ] [ 1.3644471 4.4519374 3.51681 ] [ 3.9134407 3.6897316 3.1885527 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0757578e-10 2.1905507e-10 1.9389812e-10 ] [ 2.4184548e-10 2.1195053e-10 4.7650881e-10 ] [ -7.666100000000001e-13 2.1515921e-10 3.625364e-10 ] [ 1.3644471e-10 4.451937400000001e-10 3.51681e-10 ] [ 3.913440700000001e-10 3.6897316e-10 3.1885527e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.9e-06 -3.8e-06 -1.29e-05 ] [ -1e-06 -6e-06 1.29e-05 ] [ 9.4e-06 6.2e-06 -1e-07 ] [ 9.6e-06 -5.2e-06 -3.7e-06 ] [ -1.1e-05 8.7e-06 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.10550187746e-14 -6.088271209199999e-15 -2.06680785786e-14 ] [ -1.602176634e-15 -9.613059803999999e-15 2.06680785786e-14 ] [ 1.50604603596e-14 9.9334951308e-15 -1.602176634e-16 ] [ 1.53808956864e-14 -8.331318496799998e-15 -5.9280535458e-15 ] [ -1.7623942974e-14 1.39389367158e-14 6.088271209199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.907624 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.548682347525762e-18 } }