{ "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" [ [ 2.674789 2.922951 1.929928 ] [ 1.975006 0.6488867 2.865648 ] [ 2.721706 2.680777 4.242411 ] [ 4.506989 0.6613651 2.267837 ] [ 4.914488 1.931532 3.86875 ] [ 3.976236 4.774813 0.5862588 ] [ 4.03158 4.218687 2.874326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.674789e-10 2.922951e-10 1.929928e-10 ] [ 1.975006e-10 6.488867e-11 2.865648e-10 ] [ 2.721706e-10 2.680777e-10 4.242411e-10 ] [ 4.506989e-10 6.613651e-11 2.267837e-10 ] [ 4.914488e-10 1.931532e-10 3.86875e-10 ] [ 3.976236e-10 4.774813e-10 5.862588e-11 ] [ 4.03158e-10 4.218687e-10 2.874326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -37.6231077 -35.3185092 -33.3075848 ] [ -0.7647819 -2.9384883 0.1387806 ] [ -13.7724982 -8.588282 17.5536261 ] [ -14.7954665 -40.4380097 -52.7161573 ] [ 17.7103838 44.5699776 50.2641536 ] [ 0.729391 2.6587044 -6.9028463 ] [ 48.5160796 40.0546072 24.9700281 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.027886355878046e-08 -5.658648972174972e-08 -5.336463366187344e-08 ] [ -1.225315680191004e-09 -4.707977254754336e-09 2.223510327405965e-10 ] [ -2.206597462605008e-08 -1.375994463323746e-08 2.812400934768468e-08 ] [ -2.37049505201296e-08 -6.478883373302362e-08 -8.446059476447525e-08 ] [ 2.837516286975506e-08 7.140897610029969e-08 8.053205176222016e-08 ] [ 1.168613207621933e-09 4.259714031298091e-09 -1.105957895883578e-08 ] [ 7.773132846799181e-08 6.417455521116734e-08 4.000639524253904e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.5888167 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.545564971476608e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.9578155 3.3832056 1.8571551 ] [ 2.185491 0.8396864 2.3948818 ] [ 2.6321717 2.5347348 4.3627601 ] [ 4.6502418 0.2391666 2.4233505 ] [ 5.2133882 2.1226913 4.0269785 ] [ 3.9381627 4.376347 0.4917793 ] [ 4.2235231 4.3431803 3.0782536 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9578155e-10 3.3832056e-10 1.8571551e-10 ] [ 2.185491e-10 8.396864000000001e-11 2.3948818e-10 ] [ 2.6321717e-10 2.5347348e-10 4.3627601e-10 ] [ 4.6502418e-10 2.391666e-11 2.4233505e-10 ] [ 5.2133882e-10 2.1226913e-10 4.026978500000001e-10 ] [ 3.9381627e-10 4.376347e-10 4.917793e-11 ] [ 4.2235231e-10 4.3431803e-10 3.0782536e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7.49e-05 -7.56e-05 5.8e-06 ] [ -8.08e-05 2.86e-05 -1.13e-05 ] [ 4.34e-05 -2.82e-05 -3.64e-05 ] [ -2.39e-05 6.67e-05 -3.08e-05 ] [ 3.75e-05 9.17e-05 -2.7e-06 ] [ 7.15e-05 -5.81e-05 -5.83e-05 ] [ 2.72e-05 -2.51e-05 0.0001337 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.2000302889792e-13 -1.2112455253248e-13 9.292624400640001e-15 ] [ -1.2945587096064e-13 4.582225135488e-14 -1.810459581504e-14 ] [ 6.953446534272e-14 -4.518138070656001e-14 -5.831922899712e-14 ] [ -3.829202123712e-14 1.0686518060736e-13 -4.934703992064001e-14 ] [ 6.008162327999999e-14 1.4691959612736e-13 -4.32587687616e-15 ] [ 1.145556283872e-13 -9.308646166848001e-14 -9.340689699264e-14 ] [ 4.357920408576e-14 -4.021463318208e-14 2.1421101420096e-13 ] ] } "relaxed-potential-energy" { "source-value" -24.068114 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.856136955754918e-18 } }