{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6609162 -2.3929303 -4.0219186 ] [ -7.6187823 -24.2116516 6.3507395 ] [ 6.3605306 2.4748029 -4.389983 ] [ 1.9191679 24.129779 2.0611621 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.058904483947977e-09 -3.83389698186393e-09 -6.443823951680668e-09 ] [ -1.220663488002485e-08 -3.879134214447491e-08 1.017500635169108e-08 ] [ 1.0190693423203e-08 3.965071347468041e-09 -7.033528128309446e-09 ] [ 3.074845940769832e-09 3.86601677788708e-08 3.302345728299032e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.5919214 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.152715870031205e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8175572 -0.1605722 -0.127693 ] [ 0.9414634 0.6123662 1.9731476 ] [ 3.213763 3.0993423 0.5395659 ] [ 1.4902529 2.7858383 1.9386837 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.175572e-11 -1.605722e-11 -1.27693e-11 ] [ 9.414634e-11 6.123662e-11 1.9731476e-10 ] [ 3.213763e-10 3.0993423e-10 5.395659000000001e-11 ] [ 1.4902529e-10 2.7858383e-10 1.9386837e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.4e-06 1.12e-05 -1.86e-05 ] [ 5.8e-06 2.03e-05 3.39e-05 ] [ 3.63e-05 4.3e-06 -3e-05 ] [ -4.56e-05 -3.58e-05 1.46e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.44740051072e-15 1.794437815296e-14 -2.980048514688e-14 ] [ 9.292624400640001e-15 3.252418540224e-14 5.431378744512e-14 ] [ 5.815901133504e-14 6.889359469440001e-15 -4.8065298624e-14 ] [ -7.305925390848e-14 -5.735792302464001e-14 2.339177866368e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.144215 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.241941005368672e-19 } }