{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1117211 -0.8199256 -4.0055351 ] [ -2.5537869 -5.1754771 -2.0819187 ] [ -9.8938687 -0.0350779 6.8815631 ] [ -13.5498833 10.887583 -4.8587627 ] [ 7.1265536 -9.6477473 10.4244184 ] [ 11.44479 -6.1129359 -14.096948 ] [ 8.5379163 10.9035807 7.7371829 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.781173555270059e-09 -1.313665627115413e-09 -6.417574691013791e-09 ] [ -4.091617665685307e-09 -8.292028411105785e-09 -3.335601467546329e-09 ] [ -1.585172512040489e-08 -5.620099128676033e-11 1.102547951337997e-08 ] [ -2.170930623782835e-08 1.744383093961953e-08 -7.784596003955083e-09 ] [ 1.141799756479808e-08 -1.545739516744632e-08 1.670175944591734e-08 ] [ 1.833657496796563e-08 -9.794002983429006e-09 -2.258580051023331e-08 ] [ 1.367924988620724e-08 1.74694620805461e-08 1.239633355323354e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8189729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.092519895824878e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0895846 3.0384589 1.155632 ] [ 0.9651432 1.3749832 2.463764 ] [ 1.3270991 2.7537769 4.3900692 ] [ 1.5228592 4.6724993 2.8854721 ] [ 3.717259 2.7163917 4.5631503 ] [ 4.3081124 2.9369778 2.056758 ] [ 3.8205305 5.0774252 3.4627477 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0895846e-10 3.0384589e-10 1.155632e-10 ] [ 9.651432e-11 1.3749832e-10 2.463764e-10 ] [ 1.3270991e-10 2.7537769e-10 4.3900692e-10 ] [ 1.5228592e-10 4.6724993e-10 2.8854721e-10 ] [ 3.717259e-10 2.7163917e-10 4.5631503e-10 ] [ 4.3081124e-10 2.9369778e-10 2.056758e-10 ] [ 3.8205305e-10 5.077425200000001e-10 3.4627477e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.91e-05 -2.2e-06 -2.23e-05 ] [ 2e-07 -0.0 8.1e-06 ] [ 2.27e-05 7.8e-06 -8.7e-06 ] [ -1.54e-05 4e-06 -8.1e-06 ] [ -1e-06 -1.84e-05 9e-06 ] [ 5.2e-06 1.24e-05 2.12e-05 ] [ 7.5e-06 -3.5e-06 8e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.060157345728e-14 -3.52478856576e-15 -3.572853864384e-14 ] [ 3.2043532416e-16 0.0 1.297763062848e-14 ] [ 3.636940929216e-14 1.249697764224e-14 -1.393893660096e-14 ] [ -2.467351996032e-14 6.4087064832e-15 -1.297763062848e-14 ] [ -1.6021766208e-15 -2.948004982272e-14 1.44195895872e-14 ] [ 8.33131842816e-15 1.986699009792e-14 3.396614436096001e-14 ] [ 1.2016324656e-14 -5.6076181728e-15 1.28174129664e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.875973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.864046601465204e-18 } }