{ "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" [ [ 2.026325 2.332401 2.957561 ] [ 3.78119 1.739305 1.09586 ] [ 4.095572 1.356929 3.585425 ] [ 3.432411 4.018052 0.5968462 ] [ 4.864307 3.437474 2.341714 ] [ 3.124173 4.42761 2.898506 ] [ 3.279186 3.336979 4.610213 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.026325e-10 2.332401e-10 2.957561e-10 ] [ 3.78119e-10 1.739305e-10 1.09586e-10 ] [ 4.095572e-10 1.356929e-10 3.585425e-10 ] [ 3.432411e-10 4.018052e-10 5.968462e-11 ] [ 4.864307000000001e-10 3.437474e-10 2.341714e-10 ] [ 3.124173e-10 4.42761e-10 2.898506e-10 ] [ 3.279186e-10 3.336979e-10 4.610213e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.9857488 -1.481426 -1.130932 ] [ -0.2998552 -1.7015803 -0.7990516 ] [ 1.2752705 -1.4814739 0.3213996 ] [ -0.7156298 0.7915964 -1.8901468 ] [ 4.640568 -0.5105548 -0.0225383 ] [ -2.3976398 5.0767411 -1.1451976 ] [ 0.483035 -0.6933025 4.6664667 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.783696922941655e-09 -2.373506102645261e-09 -1.811952810114586e-09 ] [ -4.804209910653082e-10 -2.726232175073851e-09 -1.280221792332833e-09 ] [ 2.043208580295926e-09 -2.373582846905397e-09 5.149389250544718e-10 ] [ -1.14656533470778e-09 1.268277245189445e-09 -3.028349012839933e-09 ] [ 7.435009556832614e-09 -8.179989641972198e-10 -3.611033733257664e-11 ] [ -3.841442432659588e-09 8.133835900274474e-09 -1.83480882091627e-09 ] [ 7.73907384028128e-10 -1.110793056642192e-09 7.476503848481728e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.172999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.430982426522178e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.651653 2.7445224 3.0349343 ] [ 3.1406331 1.7724392 1.5994911 ] [ 4.7370846 1.604401 3.226025 ] [ 3.9329808 3.800293 0.9048617 ] [ 5.6778983 3.5448297 2.397255 ] [ 2.2899866 4.7967143 2.1874181 ] [ 3.1729277 2.3855503 4.73614 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.651653e-10 2.7445224e-10 3.0349343e-10 ] [ 3.1406331e-10 1.7724392e-10 1.5994911e-10 ] [ 4.737084600000001e-10 1.604401e-10 3.226025e-10 ] [ 3.932980800000001e-10 3.800293e-10 9.048617e-11 ] [ 5.6778983e-10 3.5448297e-10 2.397255e-10 ] [ 2.2899866e-10 4.7967143e-10 2.1874181e-10 ] [ 3.1729277e-10 2.3855503e-10 4.73614e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.99e-05 -5.7e-06 -1.6e-05 ] [ 2.21e-05 3.71e-05 1.41e-05 ] [ 1.74e-05 1.04e-05 -3.02e-05 ] [ -1.45e-05 -3.13e-05 -3.4e-06 ] [ 4.2e-06 -2.12e-05 9.8e-06 ] [ -8e-07 -1.5e-06 1.46e-05 ] [ -8.6e-06 1.22e-05 1.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.188331475392e-14 -9.13240673856e-15 -2.56348259328e-14 ] [ 3.540810331968e-14 5.944075263168e-14 2.259069035328e-14 ] [ 2.787787320192e-14 1.666263685632e-14 -4.838573394816e-14 ] [ -2.32315610016e-14 -5.014812823104e-14 -5.44740051072e-15 ] [ 6.72914180736e-15 -3.396614436096001e-14 1.570133088384e-14 ] [ -1.28174129664e-15 -2.4032649312e-15 2.339177866368e-14 ] [ -1.377871893888e-14 1.954655477376e-14 1.778416049088e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.636824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.985948369876434e-18 } }