{ "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" [ [ 1.992263 2.655886 1.517325 ] [ 2.686183 2.997874 4.828117 ] [ 1.135569 3.58045 3.551064 ] [ 3.228076 1.641916 3.257925 ] [ 4.134079 3.318369 1.708542 ] [ 3.231459 4.785804 3.060879 ] [ 4.593203 3.196107 3.900565 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.992263e-10 2.655886e-10 1.517325e-10 ] [ 2.686183e-10 2.997874e-10 4.828117e-10 ] [ 1.135569e-10 3.58045e-10 3.551064e-10 ] [ 3.228076e-10 1.641916e-10 3.257925e-10 ] [ 4.134079e-10 3.318369e-10 1.708542e-10 ] [ 3.231459e-10 4.785804e-10 3.060879e-10 ] [ 4.593203e-10 3.196107e-10 3.900565e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.0052269 -2.1431737 -4.2199058 ] [ -1.2379591 -1.2681416 7.7155055 ] [ -5.8737115 2.3636998 -0.4206954 ] [ 1.0754551 -9.4575235 0.1793959 ] [ 3.0836724 0.8613754 -4.8632082 ] [ 0.8263484 9.329583 -0.1598411 ] [ 5.1314216 0.3141807 1.7687491 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.814904279379259e-09 -3.433742796453434e-09 -6.761034414738322e-09 ] [ -1.983429127526609e-09 -2.031786823383906e-09 1.236160252975381e-08 ] [ -9.4107232426241e-09 3.787064558149636e-09 -6.740283343581043e-10 ] [ 1.723069017940126e-09 -1.515262304236659e-08 2.874239168473747e-10 ] [ 4.940587825486227e-09 1.380075527612248e-09 -7.79171848012285e-09 ] [ 1.323956087115487e-09 1.494763976441313e-08 -2.560936734629549e-10 ] [ 8.22144371898813e-09 5.033729722465785e-10 2.833848456081041e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.448252 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.994429832422684e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0957637 2.351401 1.7137661 ] [ 2.31221 2.7090168 5.221724 ] [ 1.3198913 3.9226259 3.3697873 ] [ 3.1923327 0.926945 3.343411 ] [ 4.0863264 3.636661 1.1913425 ] [ 3.2064071 5.4187351 3.0697623 ] [ 4.7879008 3.2110212 3.9146238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0957637e-10 2.351401e-10 1.7137661e-10 ] [ 2.31221e-10 2.7090168e-10 5.221724e-10 ] [ 1.3198913e-10 3.9226259e-10 3.3697873e-10 ] [ 3.1923327e-10 9.26945e-11 3.343411e-10 ] [ 4.0863264e-10 3.636661e-10 1.1913425e-10 ] [ 3.2064071e-10 5.4187351e-10 3.0697623e-10 ] [ 4.7879008e-10 3.2110212e-10 3.9146238e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.51e-05 3.1e-06 3.4e-06 ] [ 3.98e-05 5.3e-06 -2.32e-05 ] [ 2.95e-05 -3.57e-05 8.8e-06 ] [ -2.26e-05 4.42e-05 -2.9e-06 ] [ 3.12e-05 -8.7e-06 3.06e-05 ] [ -2.8e-05 1.31e-05 -1.26e-05 ] [ -3.48e-05 -2.13e-05 -4.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.419286697408e-14 4.96674752448e-15 5.44740051072e-15 ] [ 6.376662950784e-14 8.491536090240001e-15 -3.717049760256e-14 ] [ 4.72642103136e-14 -5.719770536256001e-14 1.409915426304e-14 ] [ -3.620919163008e-14 7.081620663936001e-14 -4.646312200320001e-15 ] [ 4.998791056896e-14 -1.393893660096e-14 4.902660459647999e-14 ] [ -4.48609453824e-14 2.098851373248e-14 -2.018742542208e-14 ] [ -5.575574640383999e-14 -3.412636202304e-14 -6.568924145279999e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.475174 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.280484508961202e-18 } }