{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.5212969 8.4540552 -18.4730634 ] [ -24.4096294 1.0640162 28.7943972 ] [ -3.4016811 16.4979309 -11.3358135 ] [ -25.4359041 -14.2463789 39.9632521 ] [ 66.7685115 -11.7696235 -38.9487724 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.166350577607552e-08 1.354488959239267e-08 -2.959711029403616e-08 ] [ -3.910853754707233e-08 1.704741879792457e-09 4.613371000386898e-08 ] [ -5.450093929837226e-09 2.64325991795539e-08 -1.816197536744902e-08 ] [ -4.075281087793087e-08 -2.282521520463842e-08 6.402818820575651e-08 ] [ 1.06974948130916e-07 -1.885701560731827e-08 -6.240281254814031e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.442235 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.833248140669949e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0224465 2.8841118 0.5155175 ] [ 1.2963911 1.024579 2.7537953 ] [ 2.7140095 4.8289081 1.8936277 ] [ 2.4802073 3.1984114 4.3080884 ] [ 3.9989896 2.0273677 1.6318864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0224465e-10 2.8841118e-10 5.155175e-11 ] [ 1.2963911e-10 1.024579e-10 2.7537953e-10 ] [ 2.7140095e-10 4.8289081e-10 1.8936277e-10 ] [ 2.4802073e-10 3.1984114e-10 4.3080884e-10 ] [ 3.9989896e-10 2.0273677e-10 1.6318864e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.2e-06 7.4e-06 8e-07 ] [ -4.3e-06 -7.8e-06 1.9e-06 ] [ -3.4e-06 -8.4e-06 1e-07 ] [ 4.7e-06 4e-06 -6.4e-06 ] [ -1.2e-06 4.8e-06 3.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.72914180736e-15 1.185610699392e-14 1.28174129664e-15 ] [ -6.889359469440001e-15 -1.249697764224e-14 3.04413557952e-15 ] [ -5.44740051072e-15 -1.345828361472e-14 1.6021766208e-16 ] [ 7.53023011776e-15 6.4087064832e-15 -1.025393037312e-14 ] [ -1.92261194496e-15 7.69044777984e-15 5.76783583488e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.044174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.929689399964722e-18 } }