{ "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" [ [ 0.8070865 2.620947 2.881943 ] [ 2.981493 2.883992 2.450576 ] [ 2.14387 2.287305 4.61196 ] [ 1.117537 4.809867 2.516966 ] [ 2.97789 5.94727 2.412215 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.070865000000001e-11 2.620947e-10 2.881943e-10 ] [ 2.981493e-10 2.883992e-10 2.450576e-10 ] [ 2.14387e-10 2.287305e-10 4.61196e-10 ] [ 1.117537e-10 4.809867e-10 2.516966e-10 ] [ 2.97789e-10 5.947269999999999e-10 2.412215e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.0786706 -1.9229016 -1.2468433 ] [ 6.0821975 2.007326 -2.0813509 ] [ 1.7400951 -1.4301666 4.0985588 ] [ -3.5241085 1.5159133 -0.5837646 ] [ 2.7804866 -0.170171 -0.1866 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.134128054166431e-08 -3.080827987618913e-09 -1.997663185061121e-09 ] [ 9.744754637588209e-09 3.216090787523981e-09 -3.334691751661039e-09 ] [ 2.787939687188638e-09 -2.291379490369026e-09 6.566615088334103e-09 ] [ -5.646244247862557e-09 2.428760848419777e-09 -9.352939941706636e-10 ] [ 4.454830624967681e-09 -2.726439977381568e-10 -2.9896615744128e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.0230764 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.285438543497223e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.2173441 2.9761315 3.3839294 ] [ 3.9458968 3.3699655 3.1269243 ] [ 2.2516764 1.9726826 3.8830945 ] [ 0.6542969 4.9935959 2.3192788 ] [ 2.9586622 5.2370055 2.160433 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.173441e-11 2.9761315e-10 3.3839294e-10 ] [ 3.9458968e-10 3.3699655e-10 3.126924300000001e-10 ] [ 2.2516764e-10 1.9726826e-10 3.8830945e-10 ] [ 6.542969e-11 4.993595900000001e-10 2.3192788e-10 ] [ 2.9586622e-10 5.2370055e-10 2.160433e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.15e-05 -5.3e-06 1.12e-05 ] [ 2.1e-06 1e-06 5.6e-06 ] [ -1.2e-05 -7.8e-06 -5e-06 ] [ -5.2e-06 2.42e-05 -1.76e-05 ] [ -1.63e-05 -1.2e-05 5.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.04685635552e-14 -8.491536090240001e-15 1.794437815296e-14 ] [ 3.36457090368e-15 1.6021766208e-15 8.972189076479999e-15 ] [ -1.92261194496e-14 -1.249697764224e-14 -8.010883104e-15 ] [ -8.33131842816e-15 3.877267422336e-14 -2.819830852608e-14 ] [ -2.611547891904e-14 -1.92261194496e-14 9.45284206272e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.437183 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.992656383121121e-18 } }