{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8910787 -4.0374232 -0.2499816 ] [ -1.5040449 2.5339445 -0.9674043 ] [ -2.9544603 3.1591618 0.6446211 ] [ 1.8015518 -3.00718 0.0342132 ] [ -0.4712625 0.3906679 -0.4064495 ] [ 4.1260881 2.0565644 -1.5664312 ] [ 0.8932065 -1.0957353 2.5114324 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.029842081232857e-09 -6.468665059315523e-09 -4.005146751501773e-10 ] [ -2.409745575413474e-09 4.059826636304746e-09 -1.54995255232139e-09 ] [ -4.733567219741754e-09 5.061535177284446e-09 1.032796855694379e-09 ] [ 2.886404175120157e-09 -4.818033490537345e-09 5.481558916275456e-11 ] [ -7.550457597597599e-10 6.259189758770323e-10 -6.512038864358497e-10 ] [ 6.610721889181092e-09 3.29497940084958e-09 -2.509699446731689e-09 ] [ 1.431074571846595e-09 -1.755561480245274e-09 4.023758275999633e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.278339 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.447859755045685e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9310518 1.7235563 3.1223995 ] [ 3.2519425 4.0644943 1.1265364 ] [ 1.7640946 4.1206244 2.9390535 ] [ 3.415998 1.7092452 1.306696 ] [ 5.1549431 1.9284887 2.8655634 ] [ 4.9879767 4.3255501 2.6822008 ] [ 3.5772804 3.153694 4.4834337 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9310518e-10 1.7235563e-10 3.1223995e-10 ] [ 3.251942500000001e-10 4.0644943e-10 1.1265364e-10 ] [ 1.7640946e-10 4.1206244e-10 2.9390535e-10 ] [ 3.415998e-10 1.7092452e-10 1.306696e-10 ] [ 5.1549431e-10 1.9284887e-10 2.8655634e-10 ] [ 4.9879767e-10 4.3255501e-10 2.6822008e-10 ] [ 3.5772804e-10 3.153694e-10 4.4834337e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.04e-05 2.8e-05 1.36e-05 ] [ -4.7e-06 1.45e-05 1.04e-05 ] [ -5.8e-06 -3.2e-06 1.2e-06 ] [ 2.83e-05 -1.92e-05 2.3e-06 ] [ 5e-06 -3.43e-05 -2.57e-05 ] [ -6e-07 1.66e-05 -1.22e-05 ] [ -3.26e-05 -2.3e-06 1.04e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.666263685632e-14 4.48609453824e-14 2.178960204288e-14 ] [ -7.53023011776e-15 2.32315610016e-14 1.666263685632e-14 ] [ -9.292624400640001e-15 -5.126965186560001e-15 1.92261194496e-15 ] [ 4.534159836864e-14 -3.076179111936e-14 3.68500622784e-15 ] [ 8.010883104e-15 -5.495465809344e-14 -4.117593915456e-14 ] [ -9.6130597248e-16 2.659613190528e-14 -1.954655477376e-14 ] [ -5.223095783807999e-14 -3.68500622784e-15 1.666263685632e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.320543 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.93527456749611e-18 } }