{ "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" [ [ 0.7826629 0.079664 0.3147899 ] [ 0.4004832 1.295186 0.8087518 ] [ 0.7320587 0.6290848 2.788823 ] [ 1.344916 2.662801 0.2560168 ] [ 0.3963272 2.667865 2.000738 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.826629000000001e-11 7.9664e-12 3.147899e-11 ] [ 4.004832e-11 1.295186e-10 8.087518e-11 ] [ 7.320586999999999e-11 6.290848000000001e-11 2.788823e-10 ] [ 1.344916e-10 2.662801e-10 2.560168e-11 ] [ 3.963272e-11 2.667865e-10 2.000738e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 32.036334 -94.8740069 -37.9147922 ] [ -47.1566404 64.0659191 31.2883645 ] [ 1.1589113 -3.0679509 2.427679 ] [ 18.1691087 17.6859022 -15.6922424 ] [ -4.2077136 16.1901366 19.8909911 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.132786577381974e-08 -1.520049170291348e-07 -6.074619414580545e-08 ] [ -7.55532673868204e-08 1.026449186177543e-07 5.012948651797509e-08 ] [ 1.856780605738564e-09 -4.915399246239271e-09 3.889570568652485e-09 ] [ 2.911012141974611e-08 2.83359392560492e-08 -2.514174410834408e-08 ] [ -6.741500412484021e-09 2.59394585617882e-08 3.186888116752195e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.313514 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.254583748523188e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3613814 0.1347103 0.4186391 ] [ -0.4883367 1.4757169 0.7926422 ] [ 0.5775086 0.4838368 2.5925827 ] [ 1.4948848 2.445605 0.0956564 ] [ 0.7110098 2.7947318 2.2695991 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3613814e-10 1.347103e-11 4.186391e-11 ] [ -4.883367e-11 1.4757169e-10 7.926422e-11 ] [ 5.775086000000001e-11 4.838368e-11 2.5925827e-10 ] [ 1.4948848e-10 2.445605e-10 9.565640000000001e-12 ] [ 7.110098e-11 2.7947318e-10 2.2695991e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4e-06 -7e-06 -1e-07 ] [ 3e-06 8e-07 -7e-07 ] [ -3e-06 1.8e-06 -4.6e-06 ] [ -7e-06 4e-07 1.1e-06 ] [ 2.9e-06 4.1e-06 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.408706535999999e-15 -1.1215236438e-14 -1.602176634e-16 ] [ 4.806529901999999e-15 1.2817413072e-15 -1.1215236438e-15 ] [ -4.806529901999999e-15 2.8839179412e-15 -7.370012516399999e-15 ] [ -1.1215236438e-14 6.408706536e-16 1.7623942974e-15 ] [ 4.6463122386e-15 6.568924199399999e-15 7.0495771896e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.132621 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.225601494737771e-18 } }