{ "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" [ [ -2.0152085 -1.694762 -0.8472907 ] [ -0.4925296 -1.8395256 -0.0297749 ] [ 0.8374228 -1.7489629 -0.4266393 ] [ -0.3011701 -0.1747548 -0.837707 ] [ 5.1628123 -1.0823596 0.2366702 ] [ -4.3562482 8.4749011 -1.3649918 ] [ 1.1649214 -1.9345362 3.2697335 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.228719944737437e-09 -2.71530805422025e-09 -1.357509350561267e-09 ] [ -7.891194101719757e-10 -2.947244909683092e-09 -4.770464866665792e-11 ] [ 1.341699231884874e-09 -2.802147469026568e-09 -6.835515119744775e-10 ] [ -4.825276931039981e-10 -2.799880549325798e-10 -1.342154570480506e-09 ] [ 8.271737164638676e-09 -1.73413124641844e-09 3.791874612800602e-10 ] [ -6.979479020442082e-09 1.35782884060122e-08 -2.18695794954371e-09 ] [ 1.866409832149605e-09 -3.099468671731273e-09 5.238690569946557e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.877425 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.626673520390544e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8769229 2.4317724 2.6667051 ] [ 3.8603039 1.6394836 1.2239715 ] [ 4.0712053 1.3291982 3.4493422 ] [ 3.1718726 3.7606204 0.877742 ] [ 5.1525513 3.4678698 2.5007603 ] [ 2.9572364 4.7612511 2.8891348 ] [ 3.5130717 3.2585546 4.4784694 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8769229e-10 2.4317724e-10 2.6667051e-10 ] [ 3.8603039e-10 1.6394836e-10 1.2239715e-10 ] [ 4.0712053e-10 1.3291982e-10 3.4493422e-10 ] [ 3.1718726e-10 3.7606204e-10 8.77742e-11 ] [ 5.1525513e-10 3.4678698e-10 2.5007603e-10 ] [ 2.9572364e-10 4.7612511e-10 2.8891348e-10 ] [ 3.5130717e-10 3.2585546e-10 4.4784694e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.86e-05 6.6e-06 -1.64e-05 ] [ 1.13e-05 -1.46e-05 -2.54e-05 ] [ 2e-06 -1e-05 7.7e-06 ] [ -3.19e-05 -6e-06 -1.54e-05 ] [ 4.02e-05 3.8e-06 6.8e-06 ] [ -2.8e-06 1.01e-05 7e-06 ] [ -2e-07 1.01e-05 3.56e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.980048514688e-14 1.057436569728e-14 -2.627569658112e-14 ] [ 1.810459581504e-14 -2.339177866368e-14 -4.069528616832e-14 ] [ 3.2043532416e-15 -1.6021766208e-14 1.233675998016e-14 ] [ -5.110943420352001e-14 -9.6130597248e-15 -2.467351996032e-14 ] [ 6.440750015616e-14 6.08827115904e-15 1.089480102144e-14 ] [ -4.48609453824e-15 1.618198387008e-14 1.12152363456e-14 ] [ -3.2043532416e-16 1.618198387008e-14 5.703748770048e-14 ] ] } "relaxed-potential-energy" { "source-value" -32.399964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.191046483556165e-18 } }