{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.735137 1.403924 2.79869 ] [ 2.045924 2.694064 4.682831 ] [ 2.274394 3.585822 2.431289 ] [ 3.715465 2.312241 1.138099 ] [ 3.875208 1.089856 3.316209 ] [ 4.61535 3.47459 2.663723 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.735137e-10 1.403924e-10 2.79869e-10 ] [ 2.045924e-10 2.694064e-10 4.682831e-10 ] [ 2.274394e-10 3.585822e-10 2.431289e-10 ] [ 3.715465e-10 2.312241e-10 1.138099e-10 ] [ 3.875208e-10 1.089856e-10 3.316209e-10 ] [ 4.615350000000001e-10 3.47459e-10 2.663723e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.0475003 -4.7586661 -0.0134234 ] [ -1.0597541 1.4072723 4.251103 ] [ -5.08555 7.5581549 -1.1549872 ] [ 2.4031798 -2.0445691 -8.2587068 ] [ 4.0148504 -5.5514135 2.6171905 ] [ 4.7747742 3.3892215 2.5588239 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.086986974140986e-09 -7.624223571613515e-09 -2.150665765164672e-11 ] [ -1.697913242816945e-09 2.254698778159444e-09 6.811017839212741e-09 ] [ -8.147949313909439e-09 1.210949907716496e-08 -1.850493489163254e-09 ] [ 3.850318491138821e-09 -3.275760811630097e-09 -1.323190695300198e-08 ] [ 6.432499446889529e-09 -8.8943449220935e-09 4.193201431279863e-09 ] [ 7.650031592839024e-09 5.430131450012707e-09 4.099687829324277e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.8491248 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.371331006701476e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.2754185 0.9340482 2.8406062 ] [ 1.4929984 2.8139497 3.9865936 ] [ 2.8015782 4.0529891 2.4993469 ] [ 2.4347489 2.3250123 0.9699555 ] [ 4.440688 1.104719 3.4888893 ] [ 4.816046 3.3297787 3.2454495 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2754185e-10 9.340482e-11 2.8406062e-10 ] [ 1.4929984e-10 2.8139497e-10 3.9865936e-10 ] [ 2.8015782e-10 4.0529891e-10 2.4993469e-10 ] [ 2.4347489e-10 2.3250123e-10 9.699555e-11 ] [ 4.440688e-10 1.104719e-10 3.4888893e-10 ] [ 4.816046e-10 3.3297787e-10 3.2454495e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.2e-05 1.44e-05 -9.5e-06 ] [ 1.32e-05 -1.2e-06 -1.45e-05 ] [ -1.47e-05 -1.41e-05 -4.6e-06 ] [ -9e-06 8.7e-06 1.79e-05 ] [ -6.6e-06 -6.8e-06 1.19e-05 ] [ 5.2e-06 -9e-07 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.92261194496e-14 2.307134333952e-14 -1.52206778976e-14 ] [ 2.114873139456e-14 -1.92261194496e-15 -2.32315610016e-14 ] [ -2.355199632576e-14 -2.259069035328e-14 -7.370012455680001e-15 ] [ -1.44195895872e-14 1.393893660096e-14 2.867896151232001e-14 ] [ -1.057436569728e-14 -1.089480102144e-14 1.906590178752e-14 ] [ 8.33131842816e-15 -1.44195895872e-15 -1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.433831 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.831901671437829e-18 } }