{ "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" [ [ 3.046952 0.8888341 2.154791 ] [ 1.482397 2.148474 3.156267 ] [ 1.59563 3.780951 1.691413 ] [ 3.247494 1.676883 4.588179 ] [ 3.703607 3.217806 2.519536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.046952e-10 8.888341e-11 2.154791e-10 ] [ 1.482397e-10 2.148474e-10 3.156267e-10 ] [ 1.59563e-10 3.780951e-10 1.691413e-10 ] [ 3.247494e-10 1.676883e-10 4.588179e-10 ] [ 3.703607e-10 3.217806e-10 2.519536e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1459518 -2.2430901 -1.7029975 ] [ -4.9215242 -1.1418715 1.611454 ] [ -0.4059366 1.5411634 -1.0615334 ] [ 1.0350164 -0.0215651 1.8657968 ] [ 3.1464926 1.8653634 -0.71272 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.836017182523677e-09 -3.593826516567934e-09 -2.728502779780848e-09 ] [ -7.885151011941423e-09 -1.829479821257827e-09 2.581833924294643e-09 ] [ -6.503821300470413e-10 2.469215968312639e-09 -1.700763995678335e-09 ] [ 1.658279078224581e-09 -3.455109904521409e-11 2.989336012123453e-09 ] [ 5.041236881240206e-09 2.988641628775998e-09 -1.141903321176576e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.1587319 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.146955288475516e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9835895 0.9339597 1.8285636 ] [ 1.232753 1.7233867 3.187395 ] [ 1.8031033 3.7354281 2.1097061 ] [ 3.0589615 2.3583685 4.5278442 ] [ 3.9976728 2.9618051 2.4566771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9835895e-10 9.339597e-11 1.8285636e-10 ] [ 1.232753e-10 1.7233867e-10 3.187395e-10 ] [ 1.8031033e-10 3.7354281e-10 2.1097061e-10 ] [ 3.0589615e-10 2.3583685e-10 4.5278442e-10 ] [ 3.9976728e-10 2.9618051e-10 2.4566771e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 -4e-07 -1.03e-05 ] [ 1.8e-06 -7.6e-06 6.6e-06 ] [ -5.7e-06 3.3e-06 7.7e-06 ] [ -7e-06 1.64e-05 -1.48e-05 ] [ 1.14e-05 -1.18e-05 1.07e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-16 -6.408706483200001e-16 -1.650241919424e-14 ] [ 2.88391791744e-15 -1.217654231808e-14 1.057436569728e-14 ] [ -9.13240673856e-15 5.28718284864e-15 1.233675998016e-14 ] [ -1.12152363456e-14 2.627569658112e-14 -2.371221398784e-14 ] [ 1.826481347712e-14 -1.890568412544e-14 1.714328984256e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }