{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.466317 1.239453 0.412769 ] [ 1.040757 0.630375 2.483656 ] [ 2.511237 2.34811 2.379504 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.466317e-10 1.239453e-10 4.12769e-11 ] [ 1.040757e-10 6.30375e-11 2.483656e-10 ] [ 2.511237e-10 2.34811e-10 2.379504e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.6525143 0.8461281 -1.5754052 ] [ -1.1631049 -1.4679747 2.0745844 ] [ 0.5105905 0.6218466 -0.4991792 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.045443156197677e-09 1.355646660021925e-09 -2.524077379726748e-09 ] [ -1.863499478317922e-09 -2.351954744265894e-09 3.323850623556396e-09 ] [ 8.180561619025823e-10 9.963080842439692e-10 -7.997732438296474e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.2824739 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.00656328033662e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5280359 1.3119975 0.4002358 ] [ 0.9820224 0.5566429 2.5811671 ] [ 2.5082526 2.3492976 2.2945262 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5280359e-10 1.3119975e-10 4.002358e-11 ] [ 9.820224e-11 5.566429000000001e-11 2.5811671e-10 ] [ 2.5082526e-10 2.3492976e-10 2.2945262e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0 0.0 3e-07 ] [ 2e-07 2e-07 -2e-07 ] [ -2e-07 -2e-07 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 4.8065298624e-16 ] [ 3.2043532416e-16 3.2043532416e-16 -3.2043532416e-16 ] [ -3.2043532416e-16 -3.2043532416e-16 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -6.5422083 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.048177318666371e-18 } }