{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.872342 2.592209 3.748836 ] [ 1.410068 4.838391 2.869154 ] [ 2.889421 3.430048 1.520903 ] [ 4.604684 2.417867 2.466033 ] [ 4.898299 2.012755 4.844446 ] [ 5.379024 4.52793 1.309626 ] [ 5.720081 4.239448 3.464417 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.872342e-10 2.592209e-10 3.748836e-10 ] [ 1.410068e-10 4.838391e-10 2.869154e-10 ] [ 2.889421e-10 3.430048e-10 1.520903e-10 ] [ 4.604684e-10 2.417867e-10 2.466033e-10 ] [ 4.898299e-10 2.012755e-10 4.844446e-10 ] [ 5.379024e-10 4.52793e-10 1.309626e-10 ] [ 5.720081000000001e-10 4.239448000000001e-10 3.464417e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7027914 -0.2866011 4.3320541 ] [ 0.2570023 -0.1367776 -0.6607168 ] [ -2.7698684 3.3180472 -2.6312918 ] [ 7.2649346 -2.9735285 -3.2841284 ] [ 1.297141 0.2967945 0.9987008 ] [ -1.7458432 -0.2283964 -3.2408457 ] [ 1.399425 0.010462 4.4862277 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.136879129656146e-09 -4.591855856986974e-10 6.940715856243898e-09 ] [ 4.117630799442582e-10 -2.191418747745984e-10 -1.058585018651251e-09 ] [ -4.437818429734965e-09 5.316097694349125e-09 -4.215794239195801e-09 ] [ 1.163970846365813e-08 -4.764117883233068e-09 -5.261753785535805e-09 ] [ 2.078249001203394e-09 4.75517212999713e-10 1.600095086117107e-09 ] [ -2.797149181667789e-09 -3.659313753697176e-10 -5.192407254939373e-09 ] [ 2.24212603603545e-09 1.6761971944908e-11 7.187729195743561e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.149001 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.786266889464263e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8737748 2.6784799 4.562907 ] [ 0.9204454 4.6103077 1.4178523 ] [ 2.7957743 3.8691756 2.4987254 ] [ 4.5409639 2.2751597 1.658849 ] [ 5.1005147 1.978629 4.0495722 ] [ 5.1304137 4.6719504 2.0739374 ] [ 6.4120322 3.9749456 3.9615717 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8737748e-10 2.6784799e-10 4.562907e-10 ] [ 9.204454e-11 4.6103077e-10 1.4178523e-10 ] [ 2.7957743e-10 3.8691756e-10 2.4987254e-10 ] [ 4.540963900000001e-10 2.2751597e-10 1.658849e-10 ] [ 5.100514699999999e-10 1.978629e-10 4.0495722e-10 ] [ 5.1304137e-10 4.6719504e-10 2.0739374e-10 ] [ 6.4120322e-10 3.9749456e-10 3.9615717e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0057387 -0.0195267 0.0664556 ] [ -0.0832074 -0.0121341 -0.0526966 ] [ 0.1767407 0.0446432 -0.0459989 ] [ -0.0531097 -0.0930835 0.0039566 ] [ -0.0156614 -0.0154803 -0.0105554 ] [ -0.0592337 0.1306937 0.0294489 ] [ 0.028733 -0.0351123 0.0093898 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.1944110495358e-12 -3.12852224791278e-11 1.064736095184504e-10 ] [ -1.333129520558916e-10 -1.94409714946194e-11 -8.442926121124441e-11 ] [ 2.831698198168038e-10 7.152629190698879e-11 -7.36983627697026e-11 ] [ -8.50911203787498e-11 -1.49136208710939e-10 6.3391720700844e-12 ] [ -2.50923291357276e-11 -2.48021749473102e-11 -1.69116152425236e-11 ] [ -9.490285008536578e-11 2.093943923510058e-10 4.71823394770026e-11 ] [ 4.6035341224722e-11 -5.625610662599819e-11 1.50441181579332e-11 ] ] } "relaxed-potential-energy" { "source-value" -17.166704 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.750409203159433e-18 } }