{ "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" [ [ 0.4009464 1.193297 0.9558509 ] [ 0.2244953 2.906435 0.4394059 ] [ 0.3187826 2.815079 2.795658 ] [ 1.502588 0.0124763 2.860219 ] [ 2.103704 2.743898 0.1444875 ] [ 2.704733 1.991532 2.940817 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.009464e-11 1.193297e-10 9.558509e-11 ] [ 2.244953e-11 2.906435e-10 4.394059e-11 ] [ 3.187826e-11 2.815079e-10 2.795658e-10 ] [ 1.502588e-10 1.24763e-12 2.860219e-10 ] [ 2.103704e-10 2.743898e-10 1.444875e-11 ] [ 2.704733e-10 1.991532e-10 2.940817e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7667572 -21.6437684 1.4907497 ] [ -11.842587 16.3455779 -5.4770726 ] [ -1.8389884 3.8128081 7.6070857 ] [ 0.2888083 -2.1578115 0.2430134 ] [ 15.4513285 1.8428463 -4.0412698 ] [ 1.7081958 1.8003475 0.1774936 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.03501032207007e-09 -3.467713971648983e-08 2.388444316804614e-09 ] [ -1.897391602119001e-08 2.618850276484516e-08 -8.77523767014427e-09 ] [ -2.946384220402399e-09 6.108791997416868e-09 1.2187894860962e-08 ] [ 4.627219061529927e-10 -3.45719513739338e-09 3.893503880211187e-10 ] [ 2.475575728300073e-08 2.952565257587783e-09 -6.474827991905093e-09 ] [ 2.736831374508752e-09 2.884474673815728e-09 2.843760962616269e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.6176267 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.796076921521856e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1328993 0.5023376 0.7048033 ] [ 0.1034051 2.8674925 0.6358202 ] [ 0.4331247 3.2126082 2.9971727 ] [ 1.4728622 0.1383383 2.6255961 ] [ 2.5005941 2.7340423 0.4123778 ] [ 2.6123639 2.2078984 2.7606683 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.328993e-11 5.023376000000001e-11 7.048033000000001e-11 ] [ 1.034051e-11 2.8674925e-10 6.358201999999999e-11 ] [ 4.331247e-11 3.2126082e-10 2.9971727e-10 ] [ 1.4728622e-10 1.383383e-11 2.6255961e-10 ] [ 2.5005941e-10 2.7340423e-10 4.123778e-11 ] [ 2.6123639e-10 2.2078984e-10 2.7606683e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.1e-06 -1.5e-05 -1.16e-05 ] [ -2.26e-05 1.64e-05 1.2e-06 ] [ -7.6e-06 3.75e-05 -6.3e-06 ] [ 2.51e-05 3e-07 -9.1e-06 ] [ -6.9e-06 -1.01e-05 -8.9e-06 ] [ 7.9e-06 -2.92e-05 3.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.568924145279999e-15 -2.4032649312e-14 -1.858524880128e-14 ] [ -3.620919163008e-14 2.627569658112e-14 1.92261194496e-15 ] [ -1.217654231808e-14 6.008162327999999e-14 -1.009371271104e-14 ] [ 4.021463318208e-14 4.8065298624e-16 -1.457980724928e-14 ] [ -1.105501868352e-14 -1.618198387008e-14 -1.425937192512e-14 ] [ 1.265719530432e-14 -4.678355732736e-14 5.543531107968001e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.125717 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.263189352943711e-18 } }