{ "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" [ [ 0.4264597 0.3568663 1.24612 ] [ 0.1993437 1.82063 0.3429825 ] [ 0.3583889 1.799016 2.47518 ] [ 1.901803 0.1168384 0.4528213 ] [ 1.669099 0.8043485 2.197104 ] [ 2.479285 2.402454 1.01494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.264597e-11 3.568663e-11 1.24612e-10 ] [ 1.993437e-11 1.82063e-10 3.429825e-11 ] [ 3.583889e-11 1.799016e-10 2.47518e-10 ] [ 1.901803e-10 1.168384e-11 4.528213e-11 ] [ 1.669099e-10 8.043485000000001e-11 2.197104e-10 ] [ 2.479285e-10 2.402454e-10 1.01494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4722.1886951 1046.3965875 1038.5714762 ] [ 81.7943888 289.7179643 -120.155253 ] [ -1718.5456506 -448.7021201 -1151.9196469 ] [ 1846.1969012 798.6190585 1786.6148523 ] [ 4617.4779276 -1688.9091004 -1495.2149859 ] [ -104.7348721 2.8776102 -57.8964427 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.565780326295279e-06 1.676512148577401e-06 1.663974938197384e-06 ] [ 1.310490574479854e-07 4.64179349027229e-07 -1.925099372229091e-07 ] [ -2.753413663168845e-06 -7.189000465276138e-07 -1.845578727303371e-06 ] [ 2.957933512496047e-06 1.279528784454008e-06 2.862472546729105e-06 ] [ 7.398015182660756e-06 -2.70593067531724e-06 -2.395598493478782e-06 ] [ -1.678037634610982e-07 4.610439786215612e-09 -9.276032692142683e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 637.1956 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.020899893196628e-16 } "relaxed-configuration-positions" { "source-value" [ [ -0.141644 -0.2352701 0.9561928 ] [ -0.0380277 2.6302276 0.2578023 ] [ -0.3261654 2.0708343 3.0733619 ] [ 2.5687271 -0.4364295 0.0718414 ] [ 2.2539783 0.8518095 2.9136636 ] [ 2.717511 2.4189814 0.4562859 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.41644e-11 -2.352701e-11 9.561928e-11 ] [ -3.80277e-12 2.6302276e-10 2.578023e-11 ] [ -3.261654e-11 2.0708343e-10 3.0733619e-10 ] [ 2.5687271e-10 -4.364295000000001e-11 7.18414e-12 ] [ 2.2539783e-10 8.518095e-11 2.9136636e-10 ] [ 2.717511e-10 2.4189814e-10 4.562859e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.03e-05 -2.23e-05 -1.67e-05 ] [ 1.26e-05 2.06e-05 -1.83e-05 ] [ 1.52e-05 5e-07 8.3e-06 ] [ -3e-07 -1.95e-05 -1e-06 ] [ 1.31e-05 7e-06 1.9e-05 ] [ -3.03e-05 1.37e-05 8.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.650241919424e-14 -3.572853864384e-14 -2.675634956736e-14 ] [ 2.018742542208e-14 3.300483838848e-14 -2.931983216064e-14 ] [ 2.435308463616e-14 8.010883104e-16 1.329806595264e-14 ] [ -4.8065298624e-16 -3.12424441056e-14 -1.6021766208e-15 ] [ 2.098851373248e-14 1.12152363456e-14 3.04413557952e-14 ] [ -4.854595161024e-14 2.194981970496e-14 1.409915426304e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.444463 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.474475753941063e-18 } }