{ "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" [ [ 0.3288529 1.174724 0.8712814 ] [ 1.395659 1.176494 2.521247 ] [ 2.395391 0.4245255 0.3168768 ] [ 2.017962 2.536207 0.5333854 ] [ 2.744316 1.992854 1.84914 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.288529e-11 1.174724e-10 8.712814e-11 ] [ 1.395659e-10 1.176494e-10 2.521247e-10 ] [ 2.395391e-10 4.245255e-11 3.168768e-11 ] [ 2.017962e-10 2.536207e-10 5.333854e-11 ] [ 2.744316e-10 1.992854e-10 1.84914e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.7570982 -4.0096402 -11.6880146 ] [ -19.0074874 -16.0332899 27.8379356 ] [ 5.4710986 -13.5015747 -7.4404041 ] [ -16.8061718 28.105662 -39.8506113 ] [ 52.0996588 5.4388428 31.1410943 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.485871407248976e-08 -6.424151786259836e-09 -1.872626373568907e-08 ] [ -3.045335193243058e-08 -2.568816223228877e-08 4.460128958965602e-08 ] [ 8.76566626701161e-09 -2.163190732832478e-08 -1.192084149832447e-08 ] [ -2.692645554310826e-08 4.503023456850697e-08 -6.384771774944829e-08 ] [ 8.347285528101698e-08 8.713986778366411e-09 4.989353323358814e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.821368 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.335950902267326e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3402996 1.0571394 0.8980831 ] [ 1.0050979 1.172926 3.2077607 ] [ 2.6205822 0.3908677 -0.0693192 ] [ 1.8989317 2.8920184 0.0130071 ] [ 3.0172696 1.7918531 2.0423989 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.402996e-11 1.0571394e-10 8.980831e-11 ] [ 1.0050979e-10 1.172926e-10 3.2077607e-10 ] [ 2.6205822e-10 3.908677e-11 -6.93192e-12 ] [ 1.8989317e-10 2.8920184e-10 1.30071e-12 ] [ 3.0172696e-10 1.7918531e-10 2.0423989e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 -8e-07 -1.7e-06 ] [ -3e-07 1e-06 -1e-07 ] [ 5e-07 -2.5e-06 6e-07 ] [ -1.4e-06 2.3e-06 1.9e-06 ] [ 1.9e-06 -1e-07 -7e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-15 -1.28174129664e-15 -2.72370025536e-15 ] [ -4.8065298624e-16 1.6021766208e-15 -1.6021766208e-16 ] [ 8.010883104e-16 -4.005441552e-15 9.6130597248e-16 ] [ -2.24304726912e-15 3.68500622784e-15 3.04413557952e-15 ] [ 3.04413557952e-15 -1.6021766208e-16 -1.12152363456e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.744302 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.721426947121468e-18 } }