{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.875077 1.739271 0.5500127 ] [ 2.247142 4.095662 1.890424 ] [ 4.370849 2.938246 1.693427 ] [ 3.902852 1.049683 3.036341 ] [ 5.923496 0.662055 4.457524 ] [ 5.031061 2.817229 4.209838 ] [ 4.680107 5.055758 2.976326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.875077e-10 1.739271e-10 5.500127000000001e-11 ] [ 2.247142e-10 4.095662e-10 1.890424e-10 ] [ 4.370849e-10 2.938246e-10 1.693427e-10 ] [ 3.902852e-10 1.049683e-10 3.036341e-10 ] [ 5.923496e-10 6.62055e-11 4.457524e-10 ] [ 5.031061e-10 2.817229e-10 4.209838000000001e-10 ] [ 4.680106999999999e-10 5.055758e-10 2.976326e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1763389 0.5487256 2.0284793 ] [ 3.5739758 -1.669477 -0.5331821 ] [ 2.2369945 2.6327213 1.280542 ] [ -0.455198 -0.5278324 -1.3697339 ] [ -0.4135232 -0.2807679 -0.3509038 ] [ -0.0701369 1.5066268 -0.1844705 ] [ -2.6957732 -2.2099963 -0.8707309 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.486879304517589e-09 8.791553275544525e-10 3.24998211023675e-09 ] [ 5.726140470064977e-09 -2.674797018363322e-09 -8.542518952490477e-10 ] [ 3.584060288758186e-09 4.218084515942183e-09 2.051654454352474e-09 ] [ -7.293075934349184e-10 -8.45680730980754e-10 -2.194555631297205e-09 ] [ -6.625372031984025e-10 -4.498397652511123e-10 -5.62209864509879e-10 ] [ -1.123717014353875e-10 2.413882235230717e-09 -2.955543223272864e-10 ] [ -4.319104796019203e-09 -3.540804403914503e-09 -1.395064690988143e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.189994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.914358311929228e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.586908 1.8561346 1.1930633 ] [ 2.6898899 4.2523106 1.3427306 ] [ 4.7281907 2.9053676 1.7665259 ] [ 3.8972882 0.8910516 3.0070945 ] [ 6.0144354 0.723179 4.1160379 ] [ 4.9346772 2.8567613 4.2649071 ] [ 4.1791947 4.8730993 3.1235334 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.586908e-10 1.8561346e-10 1.1930633e-10 ] [ 2.6898899e-10 4.252310600000001e-10 1.3427306e-10 ] [ 4.7281907e-10 2.9053676e-10 1.7665259e-10 ] [ 3.8972882e-10 8.910516000000001e-11 3.0070945e-10 ] [ 6.0144354e-10 7.23179e-11 4.1160379e-10 ] [ 4.9346772e-10 2.8567613e-10 4.264907100000001e-10 ] [ 4.1791947e-10 4.8730993e-10 3.1235334e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.23e-05 -1.52e-05 3.23e-05 ] [ 3.4e-06 -1.76e-05 4.94e-05 ] [ -1.37e-05 -9.7e-06 4.6e-06 ] [ -2.8e-05 4.86e-05 -4.52e-05 ] [ -1.57e-05 -1.52e-05 -3.3e-06 ] [ 2.3e-06 7.2e-06 -2.4e-06 ] [ -1.07e-05 2e-06 -3.53e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.981560347584e-14 -2.435308463616e-14 5.175030485184e-14 ] [ 5.44740051072e-15 -2.819830852608e-14 7.914752506752001e-14 ] [ -2.194981970496e-14 -1.554111322176e-14 7.370012455680001e-15 ] [ -4.48609453824e-14 7.786578377088e-14 -7.241838326016e-14 ] [ -2.515417294656e-14 -2.435308463616e-14 -5.28718284864e-15 ] [ 3.68500622784e-15 1.153567166976e-14 -3.84522388992e-15 ] [ -1.714328984256e-14 3.2043532416e-15 -5.655683471424e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.518785 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.287471761422173e-18 } }