{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2437355 -0.7614142 -0.1627114 ] [ -1.8485059 -0.2800749 0.5598296 ] [ 0.5256142 0.9929945 0.2829358 ] [ -0.409545 0.743246 0.7067681 ] [ 2.282862 -1.5417666 -1.9218766 ] [ -0.3468979 1.9594231 0.5743476 ] [ -0.447263 -1.1124079 -0.0392931 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.905073197589984e-10 -1.219920029985135e-09 -2.606924010176371e-10 ] [ -2.961632936390863e-09 -4.487294568528979e-10 8.969458967518157e-10 ] [ 8.421267828004954e-10 1.590952572482986e-09 4.533131239473447e-10 ] [ -6.56163424165536e-10 1.190811364703117e-09 1.132367326147237e-09 ] [ 3.65754812491273e-09 -2.470182401250305e-09 -3.079185756582594e-09 ] [ -5.557917051846162e-10 3.13934188107546e-09 9.2020629693259e-10 ] [ -7.165943219488704e-10 -1.782273930173224e-09 -6.295448617875647e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -8.537666085572457 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.367884899850124e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0013061 2.4123133 3.1761326 ] [ 2.3776678 1.2006543 5.2433506 ] [ 2.2907294 0.0067613 3.288896 ] [ 3.4657286 1.1653798 1.6983585 ] [ 4.4064391 1.0058024 3.9283244 ] [ 3.606398 3.0971407 4.8607317 ] [ 4.2788379 3.0753507 2.6697992 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0013061e-10 2.4123133e-10 3.1761326e-10 ] [ 2.3776678e-10 1.2006543e-10 5.243350600000001e-10 ] [ 2.2907294e-10 6.7613e-13 3.288896e-10 ] [ 3.4657286e-10 1.1653798e-10 1.6983585e-10 ] [ 4.4064391e-10 1.0058024e-10 3.9283244e-10 ] [ 3.606398e-10 3.0971407e-10 4.8607317e-10 ] [ 4.2788379e-10 3.0753507e-10 2.6697992e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-06 -5.9e-06 -7.9e-06 ] [ 2.6e-06 -2.5e-06 1.76e-05 ] [ -1e-06 -1.47e-05 2.1e-06 ] [ -8e-06 7.8e-06 -1.39e-05 ] [ -1.12e-05 6.4e-06 -9e-06 ] [ -7e-06 1.34e-05 5.4e-06 ] [ 1.95e-05 -4.4e-06 5.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883104e-15 -9.45284206272e-15 -1.265719530432e-14 ] [ 4.16565921408e-15 -4.005441552e-15 2.819830852608e-14 ] [ -1.6021766208e-15 -2.355199632576e-14 3.36457090368e-15 ] [ -1.28174129664e-14 1.249697764224e-14 -2.227025502912e-14 ] [ -1.794437815296e-14 1.025393037312e-14 -1.44195895872e-14 ] [ -1.12152363456e-14 2.146916671872e-14 8.65175375232e-15 ] [ 3.12424441056e-14 -7.04957713152e-15 9.292624400640001e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }