{ "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" [ [ 0.6660422 0.1321237 2.521111 ] [ 1.154832 2.450071 0.6217319 ] [ 0.2052378 1.707228 1.69737 ] [ 2.767871 1.123615 2.427941 ] [ 1.781428 1.004966 1.555643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.660422e-11 1.321237e-11 2.521111e-10 ] [ 1.154832e-10 2.450071e-10 6.217319e-11 ] [ 2.052378e-11 1.707228e-10 1.69737e-10 ] [ 2.767871e-10 1.123615e-10 2.427941e-10 ] [ 1.781428e-10 1.004966e-10 1.555643e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -42.7189858 -42.1577226 23.8554539 ] [ 12.8361035 28.76129 -31.6693883 ] [ -48.651604 9.6093456 15.3806602 ] [ 89.5730639 18.6972561 49.688156 ] [ -11.0385775 -14.910169 -57.2548819 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.844336031304719e-08 -6.754411753589179e-08 3.822065051715218e-08 ] [ 2.056570492986905e-08 4.608066642204883e-08 -5.073995352929706e-08 ] [ -7.794846249321975e-08 1.539586886150735e-08 2.464253418490905e-08 ] [ 1.435118688340045e-07 2.995630659653019e-08 7.960920187386324e-08 ] [ -1.768575079738891e-08 -2.388872418397691e-08 -9.173243320684509e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 45.512573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.291918041305333e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4477824 -0.093951 2.683126 ] [ 1.1555457 2.7122395 0.3592708 ] [ -0.240341 1.845297 1.8330095 ] [ 3.2865882 1.1911014 2.8185473 ] [ 1.9258357 0.7633168 1.1298433 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.477824e-11 -9.395100000000001e-12 2.683126e-10 ] [ 1.1555457e-10 2.7122395e-10 3.592708e-11 ] [ -2.40341e-11 1.845297e-10 1.8330095e-10 ] [ 3.2865882e-10 1.1911014e-10 2.8185473e-10 ] [ 1.9258357e-10 7.633168000000001e-11 1.1298433e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.5313256 1.0046001 -0.7818028 ] [ 0.2055824 0.5487397 -1.0982346 ] [ -0.3179655 -1.365926 1.1270266 ] [ 0.3095558 -0.2989174 -0.1798387 ] [ 0.334153 0.1115036 0.9328494 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.512774543525325e-10 1.609546793473342e-09 -1.252586168235978e-09 ] [ 3.293793149279539e-10 8.791779182448059e-10 -1.75956580027364e-09 ] [ -5.094368903209824e-10 -2.188454702942861e-09 1.805695669539713e-09 ] [ 4.959630655930406e-10 -4.789184698303219e-10 -2.881333606550649e-10 ] [ 5.353721243701823e-10 1.786484610550349e-10 1.494589499407307e-09 ] ] } "relaxed-potential-energy" { "source-value" -9.0006044 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.442055794274961e-18 } }