{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.593534 -0.3977727 -0.1065292 ] [ -2.9664291 -0.9183925 2.1435083 ] [ -1.2546254 0.1527066 0.1745887 ] [ 0.8382235 0.4038133 -0.4730654 ] [ 4.5731633 -2.2335652 -2.2840123 ] [ -0.0675055 3.4035528 1.1979288 ] [ 0.4707073 -0.4103424 -0.652419 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.553122919249907e-09 -6.373021203324922e-10 -1.706785936725274e-10 ] [ -4.752743351280785e-09 -1.471426992218064e-09 3.434278884750753e-09 ] [ -2.010131483741848e-09 2.446629443618573e-10 2.79721933395865e-10 ] [ 1.342982094705149e-09 6.469802284280965e-10 -7.579343239894004e-10 ] [ 7.327015322360576e-09 -3.578565944472476e-09 -3.659391108679636e-09 ] [ -1.081557338754144e-10 5.453092723818379e-09 1.919293516742999e-09 ] [ 7.541562312998918e-10 -6.574409998029619e-10 -1.045290468765715e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.726964 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.160608052016325e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.5510643 2.9351431 3.0397514 ] [ 2.8227489 0.7575168 5.2351286 ] [ 1.8433254 0.6377899 3.1163424 ] [ 4.0121806 0.8523863 2.1700637 ] [ 4.9432777 0.6364019 4.2697396 ] [ 3.4290774 2.9889877 4.7215528 ] [ 3.8254326 3.1551766 2.3130146 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.5510643e-10 2.9351431e-10 3.0397514e-10 ] [ 2.8227489e-10 7.575168e-11 5.2351286e-10 ] [ 1.8433254e-10 6.377899000000001e-11 3.1163424e-10 ] [ 4.0121806e-10 8.523863e-11 2.1700637e-10 ] [ 4.943277700000001e-10 6.364018999999999e-11 4.2697396e-10 ] [ 3.4290774e-10 2.9889877e-10 4.7215528e-10 ] [ 3.8254326e-10 3.1551766e-10 2.3130146e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.5e-06 2.04e-05 -1.24e-05 ] [ 2.2e-06 -1.22e-05 3.6e-06 ] [ 2.3e-06 1.04e-05 -9e-07 ] [ 7.2e-06 1.2e-06 1.31e-05 ] [ 1.34e-05 -9.7e-06 5.3e-06 ] [ -2e-06 -6.5e-06 -3e-07 ] [ -3.16e-05 -3.7e-06 -8.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.36185012768e-14 3.268440306432e-14 -1.986699009792e-14 ] [ 3.52478856576e-15 -1.954655477376e-14 5.76783583488e-15 ] [ 3.68500622784e-15 1.666263685632e-14 -1.44195895872e-15 ] [ 1.153567166976e-14 1.92261194496e-15 2.098851373248e-14 ] [ 2.146916671872e-14 -1.554111322176e-14 8.491536090240001e-15 ] [ -3.2043532416e-15 -1.04141480352e-14 -4.8065298624e-16 ] [ -5.062878121728e-14 -5.928053496960001e-15 -1.345828361472e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.30335 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.573390593551968e-18 } }