{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 5.517305 2.823831 2.520754 ] [ 3.206819 2.056835 2.580452 ] [ 4.931014 5.152147 1.608787 ] [ 3.498861 3.411494 1.086096 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.517305000000001e-10 2.823831e-10 2.520754e-10 ] [ 3.206819e-10 2.056835e-10 2.580452e-10 ] [ 4.931014e-10 5.152147000000001e-10 1.608787e-10 ] [ 3.498861e-10 3.411494e-10 1.086096e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1514118 2.7814475 -0.1368241 ] [ -1.6969746 -5.5141571 5.6376701 ] [ 1.792147 -1.7336665 1.3792837 ] [ -1.2465842 4.4663761 -6.8801297 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.844765082071881e-09 4.456370193197715e-09 -2.192163759880794e-10 ] [ -2.718853052611497e-09 -8.834653661825201e-09 9.032543304420444e-09 ] [ 2.871336048093198e-09 -2.777639957448561e-09 2.209856115797066e-09 ] [ -1.997248077553583e-09 7.155923426076046e-09 -1.102318304422943e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.9061036 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.46262118590328e-19 } "relaxed-configuration-positions" { "source-value" [ [ 5.5694132 2.9849551 2.9739267 ] [ 3.4997617 1.9497884 2.4168607 ] [ 5.0772338 4.7723693 1.4811912 ] [ 3.0075903 3.7371941 0.9241104 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.5694132e-10 2.9849551e-10 2.9739267e-10 ] [ 3.4997617e-10 1.9497884e-10 2.4168607e-10 ] [ 5.0772338e-10 4.772369300000001e-10 1.4811912e-10 ] [ 3.0075903e-10 3.7371941e-10 9.241104e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 2e-06 9.8e-06 ] [ 8e-06 1.42e-05 -1.48e-05 ] [ -4.5e-06 -1.57e-05 -2.4e-06 ] [ -5.2e-06 -5e-07 7.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.7237002778e-15 3.204353268e-15 1.57013310132e-14 ] [ 1.2817413072e-14 2.27509082028e-14 -2.37122141832e-14 ] [ -7.209794853e-15 -2.515417315379999e-14 -3.845223921599999e-15 ] [ -8.331318496799998e-15 -8.010883169999999e-16 1.18561070916e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.6361973 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.383671352067389e-18 } }