{ "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" [ [ 2.06977 2.12479 1.528563 ] [ 2.041317 1.533814 3.912889 ] [ 1.700439 5.299543 2.410292 ] [ 0.6511626 3.199571 3.041419 ] [ 2.983959 3.688065 3.444542 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.06977e-10 2.12479e-10 1.528563e-10 ] [ 2.041317e-10 1.533814e-10 3.912889e-10 ] [ 1.700439e-10 5.299543e-10 2.410292e-10 ] [ 6.511626e-11 3.199571e-10 3.041419e-10 ] [ 2.983959e-10 3.688065e-10 3.444542e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3359046 0.3089189 0.7453678 ] [ 0.1900937 0.1315475 -0.3403105 ] [ -0.292026 -0.2601043 -0.0436557 ] [ -0.6994136 0.4248084 -0.1431777 ] [ 0.4654414 -0.6051705 -0.2182239 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.381784969391758e-10 4.949426393032531e-10 1.19421086305713e-09 ] [ 3.04563681901369e-10 2.10762329024688e-10 -5.452375269127585e-10 ] [ -4.678772298657408e-10 -4.167330284295494e-10 -6.994414190465855e-11 ] [ -1.120584118189563e-09 6.806180867994546e-10 -2.293959635599162e-10 ] [ 7.457193294324211e-10 -9.695900266978463e-10 -3.496332306797971e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -5.157085775408902 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.262562260820382e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.1181798 2.5724273 1.6356817 ] [ 1.9575216 1.833914 3.9178795 ] [ 1.7067125 4.8027637 2.4331304 ] [ 0.1952618 3.0846035 2.9846419 ] [ 3.4689719 3.5520746 3.3663714 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1181798e-10 2.5724273e-10 1.6356817e-10 ] [ 1.9575216e-10 1.833914e-10 3.9178795e-10 ] [ 1.7067125e-10 4.8027637e-10 2.4331304e-10 ] [ 1.952618e-11 3.0846035e-10 2.9846419e-10 ] [ 3.4689719e-10 3.5520746e-10 3.3663714e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.5e-06 -6.7e-06 -1.5e-06 ] [ 2.5e-06 9e-06 -6.6e-06 ] [ -1.9e-06 -1.02e-05 8.5e-06 ] [ 5.2e-06 7.9e-06 6e-07 ] [ -9.3e-06 0.0 -1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.6076181728e-15 -1.073458335936e-14 -2.4032649312e-15 ] [ 4.005441552e-15 1.44195895872e-14 -1.057436569728e-14 ] [ -3.04413557952e-15 -1.634220153216e-14 1.36185012768e-14 ] [ 8.33131842816e-15 1.265719530432e-14 9.6130597248e-16 ] [ -1.490024257344e-14 0.0 -1.6021766208e-15 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }