{ "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" [ [ 0.2100786 2.6915 2.714596 ] [ 1.703066 0.0721581 0.1101228 ] [ 2.026091 1.413329 2.796162 ] [ 1.827772 0.0799437 1.500255 ] [ 2.628484 2.60871 0.5510999 ] [ 1.843839 2.957574 1.991142 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.100786e-11 2.6915e-10 2.714596e-10 ] [ 1.703066e-10 7.215810000000001e-12 1.101228e-11 ] [ 2.026091e-10 1.413329e-10 2.796162e-10 ] [ 1.827772e-10 7.99437e-12 1.500255e-10 ] [ 2.628484e-10 2.60871e-10 5.510999e-11 ] [ 1.843839e-10 2.957574e-10 1.991142e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -68.7042909 -7.9292841 19.3932867 ] [ -30.6396768 14.3564088 -366.7943718 ] [ 15.8882749 -29.8849749 48.471807 ] [ 28.2720977 -42.5076611 351.5594093 ] [ 44.8063442 -26.7696204 -102.9993956 ] [ 10.3772509 92.7351316 50.3692643 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.100764086286222e-07 -1.270411360470117e-08 3.107147055121159e-08 ] [ -4.909017383782816e-08 2.300150253800739e-08 -5.876693671389828e-07 ] [ 2.545582258962346e-08 -4.788100809797482e-08 7.766039594332979e-08 ] [ 4.529689395591345e-08 -6.810478081930961e-08 5.632602664027182e-07 ] [ 7.178767714075767e-08 -4.288965995257074e-08 -1.650232235868504e-07 ] [ 1.662618878015576e-08 1.485780597763313e-07 8.070045766835608e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 141.76556 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.271334658666196e-17 } "relaxed-configuration-positions" { "source-value" [ [ -0.1774715 2.7715072 2.7979613 ] [ 1.833033 0.2948639 -0.3755388 ] [ 1.8512928 1.2903927 3.5000798 ] [ 1.9416673 -0.6311831 1.926473 ] [ 2.5475936 2.6710382 -0.2668249 ] [ 2.2432153 3.426596 2.0812274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.774715e-11 2.7715072e-10 2.7979613e-10 ] [ 1.833033e-10 2.948639e-11 -3.755388e-11 ] [ 1.8512928e-10 1.2903927e-10 3.5000798e-10 ] [ 1.9416673e-10 -6.311831e-11 1.926473e-10 ] [ 2.5475936e-10 2.6710382e-10 -2.668249e-11 ] [ 2.2432153e-10 3.426596e-10 2.0812274e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.06e-05 3e-07 -3.66e-05 ] [ -3.4e-05 1.34e-05 1.58e-05 ] [ 3.2e-05 -5.98e-05 1.8e-06 ] [ 1.56e-05 8.7e-06 1.76e-05 ] [ -1.6e-06 3.5e-06 3.51e-05 ] [ 4.86e-05 3.4e-05 -3.37e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.709190322048001e-14 4.8065298624e-16 -5.863966432128e-14 ] [ -5.44740051072e-14 2.146916671872e-14 2.531439060864e-14 ] [ 5.12696518656e-14 -9.581016192383999e-14 2.88391791744e-15 ] [ 2.499395528448e-14 1.393893660096e-14 2.819830852608e-14 ] [ -2.56348259328e-15 5.6076181728e-15 5.623639939008e-14 ] [ 7.786578377088e-14 5.44740051072e-14 -5.399335212096e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.890122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.026531183245974e-18 } }