{ "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" [ [ 0.5633223 0.534565 2.657113 ] [ 0.571871 1.718695 0.3060373 ] [ 0.67165 2.82724 1.843012 ] [ 2.670346 0.5025148 0.7068498 ] [ 2.297338 0.3834159 2.609917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.633223000000001e-11 5.34565e-11 2.657113e-10 ] [ 5.71871e-11 1.718695e-10 3.060373e-11 ] [ 6.7165e-11 2.82724e-10 1.843012e-10 ] [ 2.670346e-10 5.025148000000001e-11 7.068498e-11 ] [ 2.297338e-10 3.834159e-11 2.609917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -28.1677269 3.6663276 4.9840031 ] [ 0.155233 -7.9160308 -9.6261741 ] [ -0.1388761 6.9432599 10.2241215 ] [ 6.5680724 1.0155499 -14.5468593 ] [ 21.5832976 -3.7091066 8.9649087 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.512967387207325e-08 5.874104413309298e-09 7.985253310603563e-09 ] [ 2.48710685425722e-10 -1.268287958178432e-08 -1.542283121783598e-08 ] [ -2.225040424410474e-10 1.112432877556918e-08 1.638084857047703e-08 ] [ 1.05232121297003e-08 1.627090320441036e-09 -2.330663806854559e-08 ] [ 3.458025509938828e-08 -5.942643927535184e-09 1.436336724508331e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.4260846 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.693545960227236e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3359881 0.8075194 2.6667224 ] [ 0.6402184 1.403176 0.3137787 ] [ 0.4680549 3.0858393 1.9890375 ] [ 2.8070316 0.6127682 0.4792437 ] [ 2.5232343 0.0571277 2.6741467 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.359881e-11 8.075194e-11 2.6667224e-10 ] [ 6.402184e-11 1.403176e-10 3.137787e-11 ] [ 4.680549e-11 3.0858393e-10 1.9890375e-10 ] [ 2.8070316e-10 6.127682000000001e-11 4.792437e-11 ] [ 2.5232343e-10 5.71277e-12 2.6741467e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 -1.92e-05 -1.49e-05 ] [ 3.5e-06 2.51e-05 3.71e-05 ] [ 1.87e-05 -1.93e-05 -4.62e-05 ] [ -3.71e-05 2.3e-05 8.9e-06 ] [ 1.47e-05 -9.6e-06 1.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.602176634e-16 -3.076179137279999e-14 -2.38724318466e-14 ] [ 5.607618218999999e-15 4.02146335134e-14 5.94407531214e-14 ] [ 2.99607030558e-14 -3.09220090362e-14 -7.40205604908e-14 ] [ -5.94407531214e-14 3.6850062582e-14 1.42593720426e-14 ] [ 2.35519965198e-14 -1.53808956864e-14 2.41928671734e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.985955 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.240797030517547e-18 } }