{ "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" [ [ 0.4147919 0.1188417 2.672415 ] [ 0.6892124 1.667561 0.0898235 ] [ 0.5303116 1.702107 2.13154 ] [ 2.147495 1.160279 2.850921 ] [ 1.555523 2.957039 1.141113 ] [ 2.952569 2.336763 2.431712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.147919e-11 1.188417e-11 2.672415e-10 ] [ 6.892124e-11 1.667561e-10 8.98235e-12 ] [ 5.303116e-11 1.702107e-10 2.13154e-10 ] [ 2.147495e-10 1.160279e-10 2.850921e-10 ] [ 1.555523e-10 2.957039e-10 1.141113e-10 ] [ 2.952569e-10 2.336763e-10 2.431712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6413819 -29.7105908 9.312636 ] [ -6.4310491 -7.9373392 -15.6096141 ] [ -21.3236037 18.9721688 -1.7898714 ] [ -3.2232482 -36.2547101 21.2329466 ] [ 9.8619294 21.2478237 -4.5555879 ] [ 29.7573534 33.6826476 -8.590509 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.384502005158428e-08 -4.760161396991557e-08 1.492048767722043e-08 ] [ -1.030367651523688e-08 -1.271701929759937e-08 -2.500935877073003e-08 ] [ -3.416417931934438e-08 3.039676529723119e-08 -2.867690111318566e-09 ] [ -5.164212909075683e-09 -5.808644891610163e-08 3.401893063321485e-08 ] [ 1.580055272066017e-08 3.404276637502015e-08 -7.298856427379368e-09 ] [ 4.767653591436339e-08 5.396555051136524e-08 -1.376351268057199e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 21.054122 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.373242203987094e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5408693 0.176236 3.1555247 ] [ 0.7931262 2.0484825 -0.8560636 ] [ -0.3501236 1.9325704 2.1465093 ] [ 2.7148164 0.5142723 3.35749 ] [ 1.4122481 2.8305598 1.1235202 ] [ 3.1789666 2.4404696 2.390544 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.408693e-11 1.76236e-11 3.1555247e-10 ] [ 7.931262000000001e-11 2.0484825e-10 -8.560636000000001e-11 ] [ -3.501236e-11 1.9325704e-10 2.1465093e-10 ] [ 2.7148164e-10 5.142723e-11 3.35749e-10 ] [ 1.4122481e-10 2.8305598e-10 1.1235202e-10 ] [ 3.1789666e-10 2.4404696e-10 2.390544e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.160164 0.2008814 0.1195742 ] [ 0.5126756 0.6624398 0.6176288 ] [ 0.0129111 -0.4115112 0.3789818 ] [ -0.0924103 -0.5084437 0.426825 ] [ -0.8196044 -0.2465453 -1.4057456 ] [ 0.5465921 0.3031789 -0.1372642 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.566110162938112e-10 3.218474826335731e-10 1.915789876908634e-10 ] [ 8.213968603746126e-10 1.061345560247428e-09 9.89550423692759e-10 ] [ 2.068586256881088e-11 -6.59313623837353e-10 6.071957796687014e-10 ] [ -1.480576221811142e-10 -8.146166091330491e-10 6.8384903617296e-10 ] [ -1.313151007984812e-09 -3.950091156281222e-10 -2.252252735112468e-09 ] [ 8.757370837339757e-10 4.857461454998611e-10 -2.199214921128154e-10 ] ] } "relaxed-potential-energy" { "source-value" -12.942611 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.073634875630891e-18 } }