{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.44957e-10 3.5969157e-10 3.1240822e-10 ] [ 5.0839422e-10 2.2423437e-10 2.1321392e-10 ] [ 2.9316476e-10 1.8067771e-10 1.9212462e-10 ] [ 5.9632544e-10 2.4918858e-10 4.145524100000001e-10 ] [ 3.8060918e-10 2.0557887e-10 3.9311624e-10 ] [ 3.7247284e-10 3.782799e-10 1.3290097e-10 ] [ 4.6008716e-10 4.035528e-10 3.3382456e-10 ] ] "source-value" [ [ 2.44957 3.5969157 3.1240822 ] [ 5.0839422 2.2423437 2.1321392 ] [ 2.9316476 1.8067771 1.9212462 ] [ 5.9632544 2.4918858 4.1455241 ] [ 3.8060918 2.0557887 3.9311624 ] [ 3.7247284 3.782799 1.3290097 ] [ 4.6008716 4.035528 3.3382456 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.193893952521536e-11 5.585187700108801e-13 2.647292452314048e-11 ] [ -8.63701372740864e-12 -8.58590429320512e-12 1.74252729278208e-11 ] [ 7.794909695516161e-12 -4.530154395312e-12 -2.719694813808e-12 ] [ -1.102633972200768e-11 1.467081088134144e-11 -3.1394650884576e-12 ] [ 1.56035981099712e-12 -5.076977275991039e-12 -1.412655148325568e-11 ] [ 2.07393752679456e-11 1.620056911888128e-11 1.218343167754944e-11 ] [ 1.50748798251072e-12 -1.323686280572544e-11 -3.609575752532736e-11 ] ] "source-value" [ [ -0.0074517 0.0003486 0.0165231 ] [ -0.0053908 -0.0053589 0.010876 ] [ 0.0048652 -0.0028275 -0.0016975 ] [ -0.0068821 0.0091568 -0.0019595 ] [ 0.0009739 -0.0031688 -0.0088171 ] [ 0.0129445 0.0101116 0.0076043 ] [ 0.0009409 -0.0082618 -0.0225292 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.093822981128955e-18 "source-value" -50.51767 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.009064113677071e-09 -2.621010827679431e-09 -2.244890092669244e-09 ] [ -9.031433882910956e-09 -2.476761899761283e-09 5.1988628624184e-09 ] [ 7.73335759453359e-09 7.635456912554931e-09 3.649571688606078e-09 ] [ -9.216914025077082e-09 5.002296298906986e-09 -9.195289447226144e-09 ] [ 5.191181547045298e-09 6.809481351833395e-09 -1.136408207846089e-08 ] [ 3.728096287403429e-09 -7.77593383605473e-09 1.143005714822284e-08 ] [ -4.133517948890131e-10 -6.573527999799869e-09 2.525769919108962e-09 ] ] "source-value" [ [ 1.2539592 -1.6359063 -1.4011502 ] [ -5.6369777 -1.5458732 3.244875 ] [ 4.8267822 4.7656774 2.2778835 ] [ -5.7527453 3.1221878 -5.7392483 ] [ 3.2400807 4.250144 -7.0929022 ] [ 2.3268947 -4.8533562 7.1340806 ] [ -0.2579939 -4.1028735 1.5764616 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -6.256825266513346e-18 "source-value" -39.052032 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.70835e-10 3.598e-10 3.116557e-10 ] [ 5.398567e-10 2.472121e-10 1.998263e-10 ] [ 3.170959e-10 1.761622e-10 1.993892e-10 ] [ 5.798068e-10 2.225895e-10 4.322659e-10 ] [ 3.522139e-10 1.857386e-10 4.354431e-10 ] [ 3.141461e-10 3.938126e-10 8.725825e-11 ] [ 4.820562e-10 4.158888e-10 3.263025e-10 ] ] "source-value" [ [ 2.70835 3.598 3.116557 ] [ 5.398567 2.472121 1.998263 ] [ 3.170959 1.761622 1.993892 ] [ 5.798068 2.225895 4.322659 ] [ 3.522139 1.857386 4.354431 ] [ 3.141461 3.938126 0.8725825 ] [ 4.820562 4.158888 3.263025 ] ] } "instance-id" 1 }