{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 3.032432 2.348999 1.593337 ] [ 4.810482 1.062628 3.508091 ] [ 5.121871 3.223017 1.668157 ] [ 3.284691 4.649431 1.699114 ] [ 3.943916 3.285754 3.641374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.032432e-10 2.348999e-10 1.593337e-10 ] [ 4.810482000000001e-10 1.062628e-10 3.508091e-10 ] [ 5.121871e-10 3.223017e-10 1.668157e-10 ] [ 3.284691e-10 4.649431e-10 1.699114e-10 ] [ 3.943916e-10 3.285754e-10 3.641374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7803084 -2.1335151 -0.6166098 ] [ -0.1770246 0.5849651 -0.3408526 ] [ 2.9037231 -0.3136588 -0.773319 ] [ -0.9127793 2.1961332 -0.5418285 ] [ -0.0336108 -0.3339244 2.2726099 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.852368519793925e-09 -3.418268041506173e-09 -9.879178138554131e-10 ] [ -2.836246777631964e-10 9.372174149254733e-10 -5.461060713581483e-10 ] [ 4.652277302426045e-09 -5.025368004084792e-10 -1.238993632428246e-09 ] [ -1.462433666458876e-09 3.518593298191648e-09 -8.681049623352689e-10 ] [ -5.38504384100472e-11 -5.350058712024696e-10 3.641122479977076e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.565236732689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.53251987917939e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7271107 2.0342735 1.5944866 ] [ 4.6076787 1.5465707 2.9737844 ] [ 5.5804551 3.2152788 1.5788056 ] [ 3.4696787 4.2813627 1.8702489 ] [ 3.8084689 3.4923433 4.0927476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7271107e-10 2.0342735e-10 1.5944866e-10 ] [ 4.6076787e-10 1.5465707e-10 2.9737844e-10 ] [ 5.5804551e-10 3.2152788e-10 1.5788056e-10 ] [ 3.4696787e-10 4.2813627e-10 1.8702489e-10 ] [ 3.8084689e-10 3.4923433e-10 4.0927476e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.3e-06 1.97e-05 1.46e-05 ] [ -5.8e-06 -2.9e-06 -5.1e-06 ] [ 4.9e-06 7.4e-06 1e-07 ] [ -6.1e-06 -1.45e-05 -2.65e-05 ] [ -3e-07 -9.7e-06 1.69e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.16958894282e-14 3.15628796898e-14 2.33917788564e-14 ] [ -9.2926244772e-15 -4.6463122386e-15 -8.1711008334e-15 ] [ 7.850665506599998e-15 1.18561070916e-14 1.602176634e-16 ] [ -9.773277467399999e-15 -2.3231561193e-14 -4.2457680801e-14 ] [ -4.806529901999999e-16 -1.55411133498e-14 2.70767851146e-14 ] ] } "relaxed-potential-energy" { "source-value" -12.674324432689673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.03065064577907e-18 } }