{ "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" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.0636742 -11.7229035 -16.2995071 ] [ -5.380413 -1.0456026 5.0678226 ] [ -10.7621078 17.0376061 19.2281033 ] [ 21.2728309 -20.4968346 5.7351134 ] [ 8.9333642 16.2277347 -13.7315321 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.253249019142864e-08 -1.878216207033681e-08 -2.61146894213371e-08 ] [ -8.620371989869842e-09 -1.675240054169648e-09 8.119546954977129e-09 ] [ -1.724279764974915e-08 2.729725439271587e-08 3.080681782339829e-08 ] [ 3.408283260701319e-08 -3.283954946708273e-08 9.188664682820295e-09 ] [ 1.43128273842521e-08 2.5999697359091e-08 -2.200033987964095e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.52372851 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.391055812816352e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.5441015 -0.0035972 0.7705335 ] [ 0.0968401 0.8638693 2.9305567 ] [ 1.3330679 2.8905434 3.2313828 ] [ 2.3463 1.0554417 1.913302 ] [ 2.5812798 3.3361328 1.2662665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.441015000000001e-11 -3.5972e-13 7.705335e-11 ] [ 9.68401e-12 8.638693e-11 2.9305567e-10 ] [ 1.3330679e-10 2.8905434e-10 3.2313828e-10 ] [ 2.3463e-10 1.0554417e-10 1.913302e-10 ] [ 2.5812798e-10 3.3361328e-10 1.2662665e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.5e-06 -4.4e-06 -1.86e-05 ] [ 1.53e-05 3.79e-05 1.62e-05 ] [ -2e-06 -1.56e-05 -1.41e-05 ] [ 2.3e-06 3.4e-05 -1.23e-05 ] [ -2.5e-05 -5.19e-05 2.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.5220678023e-14 -7.0495771896e-15 -2.98004853924e-14 ] [ 2.45133025002e-14 6.072249442859999e-14 2.59552614708e-14 ] [ -3.204353268e-15 -2.49939554904e-14 -2.25906905394e-14 ] [ 3.685006258199999e-15 5.447400555599999e-14 -1.97067725982e-14 ] [ -4.005441585e-14 -8.315296730459999e-14 4.63029047226e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.06157 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.252911889135538e-18 } }