{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.1515051 0.6129927 0.4125648 ] [ 0.5354239 0.8367141 2.920626 ] [ 0.0380374 2.448484 2.393252 ] [ 2.476891 0.0370714 1.494005 ] [ 2.980221 0.9767319 2.515602 ] [ 2.390623 2.921281 2.114549 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.515051e-11 6.129927e-11 4.125648000000001e-11 ] [ 5.354239e-11 8.367141000000001e-11 2.920626e-10 ] [ 3.80374e-12 2.448484e-10 2.393252e-10 ] [ 2.476891e-10 3.707139999999999e-12 1.494005e-10 ] [ 2.980221e-10 9.767319e-11 2.515602e-10 ] [ 2.390623e-10 2.921281e-10 2.114549e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.9720013 -1.0482253 3.0287282 ] [ 5.3704671 -25.7075373 7.9743974 ] [ -8.9833582 25.8662881 -9.0047541 ] [ -26.6820589 -42.0314994 -47.9051913 ] [ 28.5436296 33.5394183 46.8012812 ] [ -2.2206809 9.3815557 -0.8944614 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.363847620647207e-09 -1.679442068991066e-09 4.852557512797667e-09 ] [ 8.604436830395576e-09 -4.118801524040396e-08 1.277639307924831e-08 ] [ -1.439292648431197e-08 4.144236206069725e-08 -1.442720649507295e-08 ] [ -4.274937096438857e-08 -6.734188567584923e-08 -7.675257751581155e-08 ] [ 4.573193601789486e-08 5.373607187549168e-08 7.498391856212656e-08 ] [ -3.557923020237103e-09 1.503090920927298e-08 -1.433085143288037e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 12.77502 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.046783837425242e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0309815 0.6040713 0.5268915 ] [ 0.7162218 0.46026 3.075656 ] [ 0.1294692 2.6658224 1.9512624 ] [ 2.2159689 -0.4769955 1.11129 ] [ 3.1358808 1.1783758 2.7553279 ] [ 2.3441791 3.4017411 2.4301711 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.09815e-12 6.040713e-11 5.268915e-11 ] [ 7.162218e-11 4.6026e-11 3.075656e-10 ] [ 1.294692e-11 2.6658224e-10 1.9512624e-10 ] [ 2.2159689e-10 -4.769955000000001e-11 1.11129e-10 ] [ 3.1358808e-10 1.1783758e-10 2.755327900000001e-10 ] [ 2.3441791e-10 3.4017411e-10 2.4301711e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.96e-05 -1.04e-05 -2.2e-06 ] [ -3.3e-06 -7.7e-06 2.7e-06 ] [ 1.69e-05 6.7e-06 -6.8e-06 ] [ 5.6e-06 -3.1e-06 -6.2e-06 ] [ -5e-07 1.21e-05 3.6e-06 ] [ 1e-06 2.3e-06 9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.140266176767999e-14 -1.666263685632e-14 -3.52478856576e-15 ] [ -5.28718284864e-15 -1.233675998016e-14 4.32587687616e-15 ] [ 2.707678489152e-14 1.073458335936e-14 -1.089480102144e-14 ] [ 8.972189076479999e-15 -4.96674752448e-15 -9.93349504896e-15 ] [ -8.010883104e-16 1.938633711168e-14 5.76783583488e-15 ] [ 1.6021766208e-15 3.68500622784e-15 1.44195895872e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.180008 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.271887730035697e-18 } }