{ "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" [ [ 0.2482594 0.208506 0.7144033 ] [ 0.1842271 0.5542422 2.415306 ] [ 0.3347056 2.949491 0.3757933 ] [ 2.042519 0.2544893 1.784175 ] [ 2.203059 1.053322 2.694572 ] [ 1.978392 2.822156 1.26577 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.482594e-11 2.08506e-11 7.144033e-11 ] [ 1.842271e-11 5.542422e-11 2.415306e-10 ] [ 3.347056e-11 2.949491e-10 3.757933e-11 ] [ 2.042519e-10 2.544893e-11 1.784175e-10 ] [ 2.203059e-10 1.053322e-10 2.694572e-10 ] [ 1.978392e-10 2.822156e-10 1.26577e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -23.7020423 -9.1422808 -47.982988 ] [ -20.6943274 4.4316368 29.9559702 ] [ -11.5820974 -2.3224725 -6.3899763 ] [ 3.1443016 -86.1127993 -96.8979867 ] [ 41.0209297 91.7478834 116.9193771 ] [ 11.8132357 1.3980324 4.3956038 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.797485803827266e-08 -1.464754855854872e-08 -7.687722156972695e-08 ] [ -3.315596754346085e-08 7.100264872836925e-09 4.79947551078215e-08 ] [ -1.855656567410847e-08 -3.721011141950928e-09 -1.023787063532609e-08 ] [ 5.037726512264034e-09 -1.379679137901026e-07 -1.552476888933294e-07 ] [ 6.572277452882036e-08 1.469963137913644e-07 1.873254925081189e-07 ] [ 1.892689005453992e-08 2.239894826400914e-09 7.042533642659639e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 44.927225 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.198134953242128e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.014169 0.5225784 0.4587481 ] [ 0.1278369 0.2269874 2.975646 ] [ 0.4766934 2.7448839 -0.0599145 ] [ 2.0625635 -0.5592229 1.4381039 ] [ 2.3168741 1.5086549 2.8877555 ] [ 2.0213632 3.3983249 1.5496806 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.4169e-12 5.225784e-11 4.587481e-11 ] [ 1.278369e-11 2.269874e-11 2.975646e-10 ] [ 4.766934e-11 2.7448839e-10 -5.99145e-12 ] [ 2.0625635e-10 -5.592229e-11 1.4381039e-10 ] [ 2.3168741e-10 1.5086549e-10 2.8877555e-10 ] [ 2.0213632e-10 3.3983249e-10 1.5496806e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.06e-05 -1.47e-05 7.6e-06 ] [ 1.16e-05 -1.54e-05 -4.18e-05 ] [ -5.6e-06 2.82e-05 -2.3e-05 ] [ 1.17e-05 -1.2e-06 2.03e-05 ] [ 2.06e-05 3.89e-05 2.36e-05 ] [ 1.23e-05 -3.57e-05 1.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.107013701248e-14 -2.355199632576e-14 1.217654231808e-14 ] [ 1.858524880128e-14 -2.467351996032e-14 -6.697098274944e-14 ] [ -8.972189076479999e-15 4.518138070656001e-14 -3.68500622784e-14 ] [ 1.874546646336e-14 -1.92261194496e-15 3.252418540224e-14 ] [ 3.300483838848e-14 6.232467054911999e-14 3.781136825088e-14 ] [ 1.970677243584e-14 -5.719770536256001e-14 2.130894905664e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.424762 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.311101643700425e-18 } }