{ "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" [ [ 2.690681 1.842727 3.696963 ] [ 2.658202 3.646198 2.018485 ] [ 5.329976 0.2810446 1.792372 ] [ 5.111587 2.700534 2.069297 ] [ 3.393505 1.493232 0.8693091 ] [ 5.014849 1.504764 3.993476 ] [ 3.843884 3.656776 4.040771 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.690681e-10 1.842727e-10 3.696963e-10 ] [ 2.658202e-10 3.646198e-10 2.018485e-10 ] [ 5.329976000000001e-10 2.810446e-11 1.792372e-10 ] [ 5.111587e-10 2.700534e-10 2.069297e-10 ] [ 3.393505e-10 1.493232e-10 8.693091e-11 ] [ 5.014849e-10 1.504764e-10 3.993476e-10 ] [ 3.843884e-10 3.656776e-10 4.040771000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -11.1051257 -8.5691307 5.0071333 ] [ -5.523962 4.7180196 -5.2867621 ] [ 1.6117914 -4.7557323 -1.0406226 ] [ 11.853505 6.6097383 -7.9722039 ] [ -3.0897502 -2.1044306 -3.9928384 ] [ 5.0871508 -6.3044717 5.9054221 ] [ 1.1663906 10.4060074 7.3798714 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.779237276758523e-08 -1.372926086811954e-08 8.022311910489152e-09 ] [ -8.85036277058761e-09 7.559100699596168e-09 -8.470326636351511e-09 ] [ 2.582374498686501e-09 -7.619523105843412e-09 -1.66726120079611e-09 ] [ 1.899140858553591e-08 1.058996817386634e-08 -1.277287870483058e-08 ] [ -4.950325534552125e-09 -3.371669507416117e-09 -6.397232335112479e-09 ] [ 8.150514078244017e-09 -1.010087716423523e-08 9.46152922457564e-09 ] [ 1.868763750040885e-09 1.667226177215179e-08 1.182385742159057e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.7548025 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.562891650602139e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3051863 0.65867 3.6509813 ] [ 3.1044041 3.6951638 1.6706289 ] [ 5.1854708 1.0395849 1.9417818 ] [ 5.6907262 3.3697436 1.6392058 ] [ 2.8160314 1.3303967 1.4080885 ] [ 4.5177706 1.3338648 4.2765584 ] [ 4.4230947 3.6978517 3.8934285 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3051863e-10 6.5867e-11 3.650981300000001e-10 ] [ 3.1044041e-10 3.6951638e-10 1.6706289e-10 ] [ 5.185470800000001e-10 1.0395849e-10 1.9417818e-10 ] [ 5.690726200000001e-10 3.3697436e-10 1.6392058e-10 ] [ 2.8160314e-10 1.3303967e-10 1.4080885e-10 ] [ 4.517770600000001e-10 1.3338648e-10 4.2765584e-10 ] [ 4.4230947e-10 3.6978517e-10 3.893428500000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.75e-05 1.86e-05 -1.51e-05 ] [ -3.25e-05 1.4e-06 -2.22e-05 ] [ -7.12e-05 1.4e-05 1.36e-05 ] [ 5.9e-05 3.86e-05 -7.2e-06 ] [ 4.46e-05 -3.4e-06 8.39e-05 ] [ -6.73e-05 -5.35e-05 -2.23e-05 ] [ -0.0 -1.57e-05 -3.09e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.08146921904e-13 2.980048514688e-14 -2.419286697408e-14 ] [ -5.207074017599999e-14 2.24304726912e-15 -3.556832098176e-14 ] [ -1.1407497540096e-13 2.24304726912e-14 2.178960204288e-14 ] [ 9.45284206272e-14 6.184401756288e-14 -1.153567166976e-14 ] [ 7.145707728768e-14 -5.44740051072e-15 1.3442261848512e-13 ] [ -1.0782648657984e-13 -8.57164492128e-14 -3.572853864384e-14 ] [ 0.0 -2.515417294656e-14 -4.950725758272e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }