{ "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" [ [ 1.5908215 -0.6132046 0.8263541 ] [ -84.1464729 29.3033753 -56.5953286 ] [ -6.1286767 -7.2754782 15.6185458 ] [ -13.9278753 -45.9584965 -2.3744589 ] [ 75.9899575 -15.7867248 9.1841974 ] [ 26.6222458 40.3305288 33.3406902 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.548777015165987e-09 -9.824620738870156e-10 1.323965219522225e-09 ] [ -1.348175116031608e-07 4.694918281618819e-08 -9.06757123294136e-08 ] [ -9.819222525181696e-09 -1.165660107718007e-08 2.502366893165403e-08 ] [ -2.231491618307779e-08 -7.363362861941862e-08 -3.804302536630485e-09 ] [ 1.217493333220856e-07 -2.529312139356356e-08 1.471470635509215e-08 ] [ 4.2653539813951e-08 6.461663034786109e-08 5.341767435977567e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 22.760704 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.646666782174904e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2490584 -0.4169368 0.1486947 ] [ -0.1076625 3.3794 0.25746 ] [ -0.1363217 1.5487517 2.1060359 ] [ 1.933593 0.1456371 2.6280754 ] [ 2.1154284 2.1039985 0.585933 ] [ 3.3856972 2.2487323 2.8062069 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2490584e-10 -4.169368e-11 1.486947e-11 ] [ -1.076625e-11 3.3794e-10 2.5746e-11 ] [ -1.363217e-11 1.5487517e-10 2.1060359e-10 ] [ 1.933593e-10 1.456371e-11 2.6280754e-10 ] [ 2.1154284e-10 2.1039985e-10 5.85933e-11 ] [ 3.3856972e-10 2.2487323e-10 2.8062069e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 4.6e-06 -0.0 ] [ -3.9e-06 -3.4e-06 -1.1e-06 ] [ -1.41e-05 -9.1e-06 2.4e-06 ] [ -6.3e-06 1.4e-05 -7e-07 ] [ 1.01e-05 7e-07 -2e-06 ] [ 1.42e-05 -6.8e-06 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 7.370012455680001e-15 0.0 ] [ -6.24848882112e-15 -5.44740051072e-15 -1.76239428288e-15 ] [ -2.259069035328e-14 -1.457980724928e-14 3.84522388992e-15 ] [ -1.009371271104e-14 2.24304726912e-14 -1.12152363456e-15 ] [ 1.618198387008e-14 1.12152363456e-15 -3.2043532416e-15 ] [ 2.275090801536e-14 -1.089480102144e-14 2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.21358 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.078354867787046e-18 } }