{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.430797 0.9143471 3.003228 ] [ 2.900858 2.600657 5.132587 ] [ 1.698571 3.470708 2.452381 ] [ 4.30988 2.177249 1.737833 ] [ 5.127339 2.024866 3.874492 ] [ 3.797222 3.704908 3.463102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.430797e-10 9.143471e-11 3.003228e-10 ] [ 2.900858e-10 2.600657e-10 5.132587e-10 ] [ 1.698571e-10 3.470708e-10 2.452381e-10 ] [ 4.30988e-10 2.177249e-10 1.737833e-10 ] [ 5.127339e-10 2.024866e-10 3.874492e-10 ] [ 3.797222e-10 3.704908e-10 3.463102e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -1.1938233 -0.9194023 2.4684787 ] [ -0.4266444 0.4192509 -0.2865879 ] [ 0.0674502 -0.9727941 -3.2631075 ] [ 3.9039507 -3.5253954 2.4147428 ] [ -2.3509331 4.9983409 -1.3335261 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ -1.912715796384772e-09 -1.473044882305858e-09 3.954938894666695e-09 ] [ -6.835596887069495e-10 6.717139957634705e-10 -4.591644369671286e-10 ] [ 1.080671343986268e-10 -1.558587976713059e-09 -5.228074590730154e-09 ] [ 6.254818591827943e-09 -5.648306135491084e-09 3.868844491279734e-09 ] [ -3.766610080917185e-09 8.008224998746529e-09 -2.136544358249147e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.4369216 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.191526201640989e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.430797 0.9143471 3.003228 ] [ 2.8689648 2.5797303 5.2054548 ] [ 1.6723495 3.4874932 2.4368349 ] [ 4.3194542 2.1533554 1.658026 ] [ 5.228374 1.9386206 3.9287262 ] [ 3.7447275 3.8191885 3.4313531 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.430797e-10 9.143471e-11 3.003228e-10 ] [ 2.8689648e-10 2.5797303e-10 5.205454800000001e-10 ] [ 1.6723495e-10 3.4874932e-10 2.4368349e-10 ] [ 4.3194542e-10 2.1533554e-10 1.658026e-10 ] [ 5.228374e-10 1.9386206e-10 3.9287262e-10 ] [ 3.7447275e-10 3.8191885e-10 3.4313531e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 0.0 ] [ -0.255488 -0.0169948 0.8182667 ] [ -0.6492141 0.3491723 -0.3635526 ] [ 0.3490624 -0.1314673 -0.4355739 ] [ 0.7807094 -0.4942938 0.1181012 ] [ -0.2250697 0.2935837 -0.1372414 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ -4.093369038673919e-10 -2.72286714595032e-11 1.311007787120288e-09 ] [ -1.040155661483339e-09 5.594357003000381e-10 -5.824754809499483e-10 ] [ 5.592596210879615e-10 -2.106338361950682e-10 -6.978663249602525e-10 ] [ 1.250834358624159e-09 -7.919459766910691e-10 1.892189830873608e-10 ] [ -3.606014143613898e-10 4.703729442632658e-10 -2.198849642974476e-10 ] ] } "relaxed-potential-energy" { "source-value" -8.5387472 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.368058124747292e-18 } }