{ "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" [ [ 0.4314663 0.9036294 0.7794334 ] [ 1.004832 0.4139501 2.5602 ] [ 0.3021018 2.478458 1.913452 ] [ 2.709186 0.4632097 1.441964 ] [ 2.312911 2.26354 0.6044428 ] [ 2.800336 2.901369 2.552849 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.314663000000001e-11 9.036294e-11 7.794334000000001e-11 ] [ 1.004832e-10 4.139501e-11 2.5602e-10 ] [ 3.021018e-11 2.478458e-10 1.913452e-10 ] [ 2.709186e-10 4.632097e-11 1.441964e-10 ] [ 2.312911e-10 2.26354e-10 6.044428e-11 ] [ 2.800336e-10 2.901369e-10 2.552849e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.519226 -4.3735411 -12.413363 ] [ -0.8384867 -3.3079033 10.7122879 ] [ -0.6638324 7.7255351 4.6318502 ] [ 5.1492258 -4.0524438 -0.1161575 ] [ -0.8854647 4.0202644 -4.6779419 ] [ -0.2422159 -0.0119112 1.8633244 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.036244999711501e-09 -7.007185300527915e-09 -1.988839998410375e-08 ] [ -1.343403787591744e-09 -5.299845331127169e-09 1.716297722865873e-08 ] [ -1.063576751409554e-09 1.237767172038979e-08 7.421042101487804e-09 ] [ 8.249969191980177e-09 -6.492730713465911e-09 -1.86104830830576e-10 ] [ -1.418670840883686e-09 6.44117363111454e-09 -7.494889145640732e-09 ] [ -3.880726521660308e-10 -1.908384616567296e-11 2.985374790646188e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.823763 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.054593326928007e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5709078 0.7122016 0.569598 ] [ 1.0278471 0.615437 2.9460384 ] [ 0.3415763 2.7035177 1.9288966 ] [ 2.8453681 0.4378677 1.355217 ] [ 2.1590974 2.5259484 0.3380754 ] [ 2.6160365 2.4291838 2.7145158 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.709078e-11 7.122016e-11 5.69598e-11 ] [ 1.0278471e-10 6.15437e-11 2.9460384e-10 ] [ 3.415763e-11 2.7035177e-10 1.9288966e-10 ] [ 2.8453681e-10 4.378677e-11 1.355217e-10 ] [ 2.1590974e-10 2.5259484e-10 3.380754000000001e-11 ] [ 2.6160365e-10 2.4291838e-10 2.7145158e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.2e-06 -1.8e-06 -2.7e-06 ] [ -1.1e-06 -1.9e-06 2.6e-06 ] [ -2.5e-06 2.4e-06 7e-07 ] [ 2.7e-06 -2.5e-06 -4e-07 ] [ 8e-07 1.8e-06 -2.7e-06 ] [ 2.4e-06 2.1e-06 2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.52478856576e-15 -2.88391791744e-15 -4.32587687616e-15 ] [ -1.76239428288e-15 -3.04413557952e-15 4.16565921408e-15 ] [ -4.005441552e-15 3.84522388992e-15 1.12152363456e-15 ] [ 4.32587687616e-15 -4.005441552e-15 -6.408706483200001e-16 ] [ 1.28174129664e-15 2.88391791744e-15 -4.32587687616e-15 ] [ 3.84522388992e-15 3.36457090368e-15 4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.290227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.770199746772493e-18 } }