{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.889016 4.339495 1.275975 ] [ 2.554838 3.101562 2.999193 ] [ 4.055705 3.657127 1.332404 ] [ 4.476672 4.505138 3.486766 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.889016e-10 4.339495e-10 1.275975e-10 ] [ 2.554838e-10 3.101562e-10 2.999193e-10 ] [ 4.055705e-10 3.657127e-10 1.332404e-10 ] [ 4.476672e-10 4.505138e-10 3.486766e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.64115 1.52452 -1.418752 ] [ 0.1717255 -1.1477199 2.5398127 ] [ 1.9889567 -0.1980306 -1.1151336 ] [ -0.5195322 -0.1787695 -0.0059271 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.62941216122592e-09 2.442550301942016e-09 -2.273091285113242e-09 ] [ 2.751345812951905e-10 -1.838849991006914e-09 4.069228529150924e-09 ] [ 3.186659924523519e-09 -3.172799975229965e-10 -1.786640982988539e-09 ] [ -8.323823445927898e-10 -2.864203134121056e-10 -9.49626104914368e-12 ] ] } "unrelaxed-potential-energy" { "source-value" -10.402445 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.666655417815786e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1735206 4.6949648 1.6283835 ] [ 2.6396567 2.7813509 3.0315082 ] [ 4.1519354 3.360947 1.2356695 ] [ 4.0111183 4.7660593 3.1987768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1735206e-10 4.6949648e-10 1.6283835e-10 ] [ 2.6396567e-10 2.7813509e-10 3.0315082e-10 ] [ 4.1519354e-10 3.360947e-10 1.2356695e-10 ] [ 4.0111183e-10 4.7660593e-10 3.1987768e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.24e-05 2.8e-06 -7e-07 ] [ -1.03e-05 -7.5e-06 2e-06 ] [ 1.18e-05 -1.8e-06 -3.1e-06 ] [ 1.1e-05 6.5e-06 1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.986699009792e-14 4.48609453824e-15 -1.12152363456e-15 ] [ -1.650241919424e-14 -1.2016324656e-14 3.2043532416e-15 ] [ 1.890568412544e-14 -2.88391791744e-15 -4.96674752448e-15 ] [ 1.76239428288e-14 1.04141480352e-14 2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.299968 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.970672116618813e-18 } }