{ "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" [ [ 2.298469 1.653345 1.333865 ] [ 0.8562694 1.609736 3.078689 ] [ 0.6106735 3.571622 1.917701 ] [ 2.573163 3.601998 2.791817 ] [ 3.634663 1.831744 3.381139 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.298469e-10 1.653345e-10 1.333865e-10 ] [ 8.562694e-11 1.609736e-10 3.078689e-10 ] [ 6.106735e-11 3.571622e-10 1.917701e-10 ] [ 2.573163e-10 3.601998e-10 2.791817e-10 ] [ 3.634663e-10 1.831744e-10 3.381139e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.2439533 -7.7748736 -9.903379 ] [ -9.5047758 -7.8496022 5.1490683 ] [ -7.3003809 5.9382477 -2.4810279 ] [ 6.6979811 12.7687717 3.2590242 ] [ 6.8632222 -3.0825436 3.9763144 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.197386136227009e-09 -1.245672071159513e-08 -1.586696230072168e-08 ] [ -1.522832957270562e-08 -1.257644912742025e-08 8.249716849162401e-09 ] [ -1.169649960091486e-08 9.514121633459372e-09 -3.97504489693252e-09 ] [ 1.073134872498027e-08 2.045782749407267e-08 5.221532379861423e-09 ] [ 1.099609415219554e-08 -4.938779288516667e-09 6.370757968630381e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.1547567 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.45230080825216e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.439142 0.5449074 2.0530388 ] [ 0.2820148 1.5100375 2.033967 ] [ 0.4916881 3.7792491 2.6598571 ] [ 2.7784012 4.2165915 3.0657004 ] [ 3.9819918 2.2176595 2.6906478 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.439142e-10 5.449074e-11 2.0530388e-10 ] [ 2.820148e-11 1.5100375e-10 2.033967e-10 ] [ 4.916881e-11 3.7792491e-10 2.6598571e-10 ] [ 2.7784012e-10 4.2165915e-10 3.0657004e-10 ] [ 3.9819918e-10 2.2176595e-10 2.6906478e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.52e-05 1.09e-05 -5e-07 ] [ 1.86e-05 -1.36e-05 1e-07 ] [ -1.3e-06 2.07e-05 4.5e-06 ] [ -1.78e-05 -1.09e-05 -5.3e-06 ] [ 1.57e-05 -7e-06 1.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.435308463616e-14 1.746372516672e-14 -8.010883104e-16 ] [ 2.980048514688e-14 -2.178960204288e-14 1.6021766208e-16 ] [ -2.08282960704e-15 3.316505605055999e-14 7.2097947936e-15 ] [ -2.851874385024e-14 -1.746372516672e-14 -8.491536090240001e-15 ] [ 2.515417294656e-14 -1.12152363456e-14 1.76239428288e-15 ] ] } "relaxed-potential-energy" { "source-value" -7.0960126 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.136906548862222e-18 } }