{ "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" [ [ 0.4711414 1.535718 0.6051258 ] [ 0.1383881 2.176586 2.72717 ] [ 2.449817 0.7251628 0.0780297 ] [ 1.858809 0.1214998 2.575793 ] [ 2.444403 2.05802 2.37174 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.711414e-11 1.535718e-10 6.051258000000001e-11 ] [ 1.383881e-11 2.176586e-10 2.72717e-10 ] [ 2.449817e-10 7.251628e-11 7.80297e-12 ] [ 1.858809e-10 1.214998e-11 2.575793e-10 ] [ 2.444403e-10 2.05802e-10 2.37174e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.500335 0.4952689 -1.9836338 ] [ -0.6996134 0.7543894 1.2819345 ] [ 1.538446 -0.5933006 0.0301409 ] [ -0.4124607 -4.5958971 0.6876456 ] [ 2.0739631 3.9395394 -0.0160871 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.005978281167969e-09 7.935082525893331e-10 -3.178131698588663e-09 ] [ -1.120904233078399e-09 1.20866505965934e-09 2.053885485296938e-09 ] [ 2.464862213563277e-09 -9.505723504266125e-10 4.829104530987073e-11 ] [ -6.608348905388025e-10 -7.36343888522252e-09 1.101729703715989e-09 ] [ 3.322855191221892e-09 6.31183792340046e-09 -2.577437551647168e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -8.7082692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.395218531987272e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.1371609 1.6511281 0.2746935 ] [ 0.3263936 1.9069572 2.641237 ] [ 2.3633521 0.802481 0.4348718 ] [ 1.7824751 -0.1123451 2.6764559 ] [ 2.7531769 2.3687653 2.3306002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.371609e-11 1.6511281e-10 2.746935e-11 ] [ 3.263936e-11 1.9069572e-10 2.641237e-10 ] [ 2.3633521e-10 8.024810000000001e-11 4.348718e-11 ] [ 1.7824751e-10 -1.123451e-11 2.6764559e-10 ] [ 2.7531769e-10 2.3687653e-10 2.3306002e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 -4.9e-06 -3e-07 ] [ 1.25e-05 1.15e-05 5.8e-06 ] [ 2.5e-06 -8.8e-06 6e-07 ] [ -7.6e-06 -2.17e-05 -1.05e-05 ] [ -7.3e-06 2.38e-05 4.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 -7.850665441919999e-15 -4.8065298624e-16 ] [ 2.002720776e-14 1.84250311392e-14 9.292624400640001e-15 ] [ 4.005441552e-15 -1.409915426304e-14 9.6130597248e-16 ] [ -1.217654231808e-14 -3.476723267136e-14 -1.68228545184e-14 ] [ -1.169588933184e-14 3.813180357504e-14 7.04957713152e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }