{ "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" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 19.9955309 28.9511248 48.5048758 ] [ 3.4325331 6.9012454 -14.6787138 ] [ 47.8242408 -2.310039 26.0442028 ] [ 42.9954332 6.349932 -62.9758632 ] [ 5.9207121 -38.5245715 9.1992669 ] [ -41.9243925 -9.5977144 30.4072018 ] [ -78.2440576 8.2300226 -36.5009703 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.203637239240498e-08 4.638481568257791e-08 7.771337864183205e-08 ] [ 5.499524328251586e-09 1.105701412537998e-08 -2.351789226753335e-08 ] [ 7.662288114854945e-08 -3.701090509428726e-09 4.172741317731737e-08 ] [ 6.888627844174784e-08 1.017371267788889e-08 -1.008984565250205e-07 ] [ 9.48602658326107e-09 -6.172316829216233e-08 1.473885047710961e-08 ] [ -6.717028205814484e-08 -1.537723375148533e-08 4.871770822928274e-08 ] [ -1.253608008360701e-07 1.318594990701193e-08 -5.848100173298796e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.6122917236328362 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.809994927961158e-20 } "relaxed-configuration-positions" { "source-value" [ [ 2.872972 1.012553 2.780557 ] [ 2.489863 2.81954 0.4602746 ] [ 1.064652 2.650766 2.601591 ] [ 2.280466 2.401905 4.700098 ] [ 2.677321 4.010574 3.508674 ] [ 4.446125 3.093023 2.174548 ] [ 4.337554 1.939772 4.152011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872972e-10 1.012553e-10 2.780557e-10 ] [ 2.489863e-10 2.81954e-10 4.602746e-11 ] [ 1.064652e-10 2.650766e-10 2.601591e-10 ] [ 2.280466e-10 2.401905e-10 4.700098e-10 ] [ 2.677321e-10 4.010574e-10 3.508674e-10 ] [ 4.446125000000001e-10 3.093023e-10 2.174548e-10 ] [ 4.337554e-10 1.939772e-10 4.152011e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 19.9955309 28.9511248 48.5048758 ] [ 3.4325331 6.9012454 -14.6787138 ] [ 47.8242408 -2.310039 26.0442028 ] [ 42.9954332 6.349932 -62.9758632 ] [ 5.9207121 -38.5245715 9.1992669 ] [ -41.9243925 -9.5977144 30.4072018 ] [ -78.2440576 8.2300226 -36.5009703 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.203637239240498e-08 4.638481568257791e-08 7.771337864183205e-08 ] [ 5.499524328251586e-09 1.105701412537998e-08 -2.351789226753335e-08 ] [ 7.662288114854945e-08 -3.701090509428726e-09 4.172741317731737e-08 ] [ 6.888627844174784e-08 1.017371267788889e-08 -1.008984565250205e-07 ] [ 9.48602658326107e-09 -6.172316829216233e-08 1.473885047710961e-08 ] [ -6.717028205814484e-08 -1.537723375148533e-08 4.871770822928274e-08 ] [ -1.253608008360701e-07 1.318594990701193e-08 -5.848100173298796e-08 ] ] } "relaxed-potential-energy" { "source-value" 0.6122917236328362 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.809994927961158e-20 } }