{ "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" [ [ 0.9865114 1.002248 2.003773 ] [ 2.302262 0.4465448 0.4828732 ] [ 2.913212 0.9916658 2.458282 ] [ 2.765138 2.782808 0.4747325 ] [ 1.558206 2.989621 2.793764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.865114e-11 1.002248e-10 2.003773e-10 ] [ 2.302262e-10 4.465448e-11 4.828732e-11 ] [ 2.913212e-10 9.916658000000001e-11 2.458282e-10 ] [ 2.765138e-10 2.782808e-10 4.747325e-11 ] [ 1.558206e-10 2.989621e-10 2.793764e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.1174496 -0.683 0.8743481 ] [ 1.4193772 -1.5666619 -5.0285964 ] [ 6.1715385 0.6246075 3.6381709 ] [ -0.2694677 0.1466177 0.8275732 ] [ 0.7960016 1.4784366 -0.3114958 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.300558796964231e-08 -1.0942866320064e-09 1.4008600842609e-09 ] [ 2.274092965936566e-09 -2.510069068878107e-09 -8.056699587519045e-09 ] [ 9.8878946990671e-09 1.000731533676336e-09 5.828992358454895e-09 ] [ -4.317348490007482e-10 2.349074511354682e-10 1.325918433040643e-09 ] [ 1.275335153639393e-09 2.368716555855041e-09 -4.990712882373927e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -14.028362 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.247591362451913e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7085997 0.7852914 2.1811909 ] [ 2.1700604 0.5497509 0.3098167 ] [ 3.1246954 1.1218664 2.5045062 ] [ 2.9917153 2.7602205 0.6732663 ] [ 1.5302586 2.9957585 2.5446447 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.085997000000001e-11 7.852914e-11 2.1811909e-10 ] [ 2.1700604e-10 5.497509000000001e-11 3.098167e-11 ] [ 3.1246954e-10 1.1218664e-10 2.5045062e-10 ] [ 2.9917153e-10 2.7602205e-10 6.732663e-11 ] [ 1.5302586e-10 2.9957585e-10 2.5446447e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.28e-05 1.3e-05 -9e-06 ] [ -7.2e-06 7.8e-06 1e-07 ] [ 2e-07 -1.4e-06 6e-06 ] [ -1.69e-05 -1.46e-05 1.53e-05 ] [ 1.1e-06 -4.9e-06 -1.23e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.652962695424e-14 2.08282960704e-14 -1.44195895872e-14 ] [ -1.153567166976e-14 1.249697764224e-14 1.6021766208e-16 ] [ 3.2043532416e-16 -2.24304726912e-15 9.6130597248e-15 ] [ -2.707678489152e-14 -2.339177866368e-14 2.451330229824e-14 ] [ 1.76239428288e-15 -7.850665441919999e-15 -1.970677243584e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }