{ "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" [ [ 1.097689 0.3905239 0.41263 ] [ 0.032965 0.0756626 2.808384 ] [ 2.827906 0.6568563 1.349893 ] [ 2.515385 2.187975 0.7174512 ] [ 1.727021 2.867394 2.060494 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.097689e-10 3.905239e-11 4.1263e-11 ] [ 3.2965e-12 7.56626e-12 2.808384e-10 ] [ 2.827906e-10 6.568562999999999e-11 1.349893e-10 ] [ 2.515385e-10 2.187975e-10 7.174512e-11 ] [ 1.727021e-10 2.867394e-10 2.060494e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.5261281 -2.3224294 -2.2136677 ] [ 0.7477316 0.2559257 -1.2166353 ] [ 8.9429863 -14.9457331 9.7683409 ] [ 5.4351811 10.8042848 -18.9015729 ] [ -7.5997708 6.2079519 12.5635349 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.205818648696592e-08 -3.720942088138572e-09 -3.546686635160108e-09 ] [ 1.197998088153377e-09 4.100381732018745e-10 -1.949264633699994e-09 ] [ 1.432824356999469e-08 -2.394570415353671e-08 1.565060741398443e-08 ] [ 8.708120088234027e-09 1.73103725110248e-08 -3.028365819672686e-08 ] [ -1.217617509919851e-08 9.946235397230941e-09 2.012900189138487e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.073746224591099 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.129037580912126e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0232155 0.276762 0.2086047 ] [ 0.4432458 0.562176 2.4719848 ] [ 2.7646596 0.5159904 1.8486594 ] [ 2.2749074 2.2690343 0.2781119 ] [ 1.6949377 2.5544492 2.5414913 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0232155e-10 2.76762e-11 2.086047e-11 ] [ 4.432458e-11 5.62176e-11 2.4719848e-10 ] [ 2.7646596e-10 5.159904e-11 1.8486594e-10 ] [ 2.2749074e-10 2.2690343e-10 2.781119e-11 ] [ 1.6949377e-10 2.5544492e-10 2.5414913e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5e-07 -1.9e-06 2.2e-06 ] [ -3e-06 1.9e-06 2e-07 ] [ 2.5e-06 2.6e-06 -4.8e-06 ] [ 2.8e-06 -8e-07 2e-07 ] [ -1.8e-06 -1.8e-06 2.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.010883104e-16 -3.04413557952e-15 3.52478856576e-15 ] [ -4.8065298624e-15 3.04413557952e-15 3.2043532416e-16 ] [ 4.005441552e-15 4.16565921408e-15 -7.69044777984e-15 ] [ 4.48609453824e-15 -1.28174129664e-15 3.2043532416e-16 ] [ -2.88391791744e-15 -2.88391791744e-15 3.36457090368e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }