{ "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" [ [ 1.715482 1.558119 0.3191032 ] [ 2.111919 2.384646 2.793656 ] [ 0.6473775 3.949576 0.9928713 ] [ 3.842985 1.188798 1.171985 ] [ 3.145034 3.056438 0.3971002 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.715482e-10 1.558119e-10 3.191032e-11 ] [ 2.111919e-10 2.384646e-10 2.793656e-10 ] [ 6.473775000000001e-11 3.949576e-10 9.928713000000001e-11 ] [ 3.842985e-10 1.188798e-10 1.171985e-10 ] [ 3.145034e-10 3.056438e-10 3.971002e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.7159764 -2.920186 -1.5340285 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 4.4723076 -3.5311123 2.5737848 ] [ 2.2436688 6.4512983 -1.0397563 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.076018037392455e-08 -4.678653737587469e-09 -2.457784598340893e-09 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 7.165426677746158e-09 -5.657465572479317e-09 4.123657833530404e-09 ] [ 3.594753696178391e-09 1.033611931006679e-08 -1.665873235189511e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.3434107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.356734457272563e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.367956 3.416354 1.4005078 ] [ 2.2408085 2.5025368 2.1071954 ] [ -1.086758 4.0538545 -0.124201 ] [ 5.7439904 0.614952 0.5172323 ] [ 4.1968006 1.5498797 1.7739813 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.67956e-11 3.416354e-10 1.4005078e-10 ] [ 2.2408085e-10 2.5025368e-10 2.1071954e-10 ] [ -1.086758e-10 4.0538545e-10 -1.24201e-11 ] [ 5.743990400000001e-10 6.14952e-11 5.172323e-11 ] [ 4.196800600000001e-10 1.5498797e-10 1.7739813e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.2180396 0.0935679 -0.1943337 ] [ 0.0780297 -0.0250666 0.0326361 ] [ 0.0992836 -0.039125 0.1632356 ] [ -0.1011267 0.0730536 0.1475528 ] [ 0.1418531 -0.1024299 -0.1490907 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.493379495285837e-10 1.499123018373523e-10 -3.11356910773561e-10 ] [ 1.250173610680377e-10 -4.016112048294528e-11 5.228879641409088e-11 ] [ 1.590698627488589e-10 -6.268516028880001e-11 2.615322620022605e-10 ] [ -1.620228344786554e-10 1.170447699852749e-10 2.364056464935783e-10 ] [ 2.272737204080045e-10 -1.641107910508819e-10 -2.388696339187066e-10 ] ] } "relaxed-potential-energy" { "source-value" -11.143482 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.785382633470563e-18 } }