{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.6528742 1.7032194 1.9005087 ] [ -2.1925213 -4.0480771 2.0235054 ] [ -13.2819655 -1.6015995 -4.8119915 ] [ 7.5487705 -6.7075744 14.3917173 ] [ -9.5259274 5.0876905 -1.9606024 ] [ 10.1443301 18.1623294 -5.0524468 ] [ 3.6544394 -12.5959883 -6.4906906 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.852549641963504e-09 2.728858302773004e-09 3.044950606767001e-09 ] [ -3.512806367466023e-09 -6.485734488815865e-09 3.242013043942552e-09 ] [ -2.128005460237219e-08 -2.56604527478497e-09 -7.709660280788325e-09 ] [ 1.209446361088473e-08 -1.074671888595659e-08 2.30580729912229e-08 ] [ -1.526221817171813e-08 8.151378772966263e-09 -3.14123132796437e-09 ] [ 1.625300851989772e-08 2.909925954394849e-08 -8.094912140795774e-09 ] [ 5.855057368810379e-09 -2.018099797013034e-08 -1.039923273216633e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -15.76583 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.525964423350726e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8878048 1.024123 1.8324014 ] [ 1.8933578 2.3502698 3.6939372 ] [ 1.6322189 3.9574122 1.8157041 ] [ 2.9607332 4.6306567 3.879452 ] [ 4.349968 2.7089323 3.133866 ] [ 3.7217489 5.4671703 1.6581957 ] [ 3.7337593 3.1260002 0.747349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8878048e-10 1.024123e-10 1.8324014e-10 ] [ 1.8933578e-10 2.3502698e-10 3.6939372e-10 ] [ 1.6322189e-10 3.9574122e-10 1.8157041e-10 ] [ 2.9607332e-10 4.6306567e-10 3.879452e-10 ] [ 4.349968e-10 2.7089323e-10 3.133866e-10 ] [ 3.7217489e-10 5.467170300000001e-10 1.6581957e-10 ] [ 3.7337593e-10 3.1260002e-10 7.473490000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.37e-05 -1.86e-05 1.64e-05 ] [ -8.38e-05 -7.34e-05 2.3e-06 ] [ -8.46e-05 -4.45e-05 3.9e-06 ] [ 7.05e-05 -1.27e-05 4.43e-05 ] [ 1.81e-05 5.84e-05 2.87e-05 ] [ 6.23e-05 0.0001213 -4.1e-05 ] [ 4.12e-05 -3.04e-05 -5.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.797158591296e-14 -2.980048514688e-14 2.627569658112e-14 ] [ -1.3426240082304e-13 -1.1759976396672e-13 3.68500622784e-15 ] [ -1.3554414211968e-13 -7.129685962560001e-14 6.24848882112e-15 ] [ 1.129534517664e-13 -2.034764308416e-14 7.097642430144e-14 ] [ 2.899939683648e-14 9.356711465472001e-14 4.598246901696e-14 ] [ 9.981560347584e-14 1.9434402410304e-13 -6.56892414528e-14 ] [ 6.600967677696001e-14 -4.870616927232e-14 -8.747884349568e-14 ] ] } "relaxed-potential-energy" { "source-value" -26.335586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.219426018426779e-18 } }