{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.497272 0.041495 0.0459008 ] [ 0.5144624 2.623314 0.1336692 ] [ 0.1881884 1.665255 2.217108 ] [ 2.303156 0.3070008 2.474488 ] [ 2.009269 2.269424 0.9602388 ] [ 2.927445 2.103094 2.701001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.497272e-10 4.1495e-12 4.59008e-12 ] [ 5.144624e-11 2.623314e-10 1.336692e-11 ] [ 1.881884e-11 1.665255e-10 2.217108e-10 ] [ 2.303156e-10 3.070008e-11 2.474488e-10 ] [ 2.009269e-10 2.269424e-10 9.602388e-11 ] [ 2.927445e-10 2.103094e-10 2.701001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1777374 0.8824769 0.8470338 ] [ -14.7985671 3.035542 -8.0650417 ] [ -0.0781596 -0.4759173 0.8279367 ] [ -3.5882616 -8.577535 -1.5956907 ] [ 12.7752307 -2.6872061 0.9200307 ] [ 5.5120201 7.8226395 7.0657312 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.847667069217779e-10 1.413883857576059e-09 1.357097751387383e-09 ] [ -2.370991822896006e-08 4.863474423856474e-09 -1.292162125751709e-08 ] [ -1.252254838110797e-10 -7.625035714942599e-10 1.326500824242303e-09 ] [ -5.749028844834402e-09 -1.374272604109373e-08 -2.556578333567987e-09 ] [ 2.046817595286642e-08 -4.305378788691147e-09 1.474051677958258e-09 ] [ 8.831229737599679e-09 1.25332501198466e-08 1.132054933749713e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -10.144796 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.625375497398536e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7442217 0.318513 0.0417566 ] [ 0.2803099 2.2013215 0.3391423 ] [ 0.3019318 1.8474086 2.6862681 ] [ 1.7658457 -0.0353992 2.388882 ] [ 2.6629308 2.515825 0.3646157 ] [ 2.6845529 2.1619139 2.7117411 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7442217e-10 3.18513e-11 4.17566e-12 ] [ 2.803099e-11 2.2013215e-10 3.391423e-11 ] [ 3.019318e-11 1.8474086e-10 2.6862681e-10 ] [ 1.7658457e-10 -3.53992e-12 2.388882e-10 ] [ 2.6629308e-10 2.515825e-10 3.646157e-11 ] [ 2.6845529e-10 2.1619139e-10 2.7117411e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.9e-06 -5.6e-06 -2.3e-06 ] [ -6.6e-06 1e-06 1.7e-06 ] [ -9e-07 8e-07 -1.3e-06 ] [ -2e-06 -1.8e-06 1.3e-06 ] [ 4.7e-06 5.1e-06 -2.5e-06 ] [ 2.8e-06 5e-07 3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.04413557952e-15 -8.972189076479999e-15 -3.68500622784e-15 ] [ -1.057436569728e-14 1.6021766208e-15 2.72370025536e-15 ] [ -1.44195895872e-15 1.28174129664e-15 -2.08282960704e-15 ] [ -3.2043532416e-15 -2.88391791744e-15 2.08282960704e-15 ] [ 7.53023011776e-15 8.17110076608e-15 -4.005441552e-15 ] [ 4.48609453824e-15 8.010883104e-16 5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.513765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.806014482518531e-18 } }