{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.950368 -21.1488071 -22.878951 ] [ -35.6926219 11.1091407 10.706249 ] [ -12.2193265 -19.3276052 27.363423 ] [ 2.948109 11.153403 -22.3847462 ] [ 6.5206183 5.5646918 14.7513271 ] [ 33.8975441 -20.1782274 -4.4799173 ] [ 11.4960449 32.8274041 -3.0773847 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.113571711555645e-08 -3.388412429342905e-08 -3.665612040062878e-08 ] [ -5.718588434323407e-08 1.779880550671774e-08 1.715330184426338e-08 ] [ -1.957751924022189e-08 -3.096623718749251e-08 4.3841036595661e-08 ] [ 4.723391315370067e-09 1.786972152896059e-08 -3.586431702418164e-08 ] [ 1.044718219342064e-08 8.91561910391747e-09 2.363423140539346e-08 ] [ 5.430985265955697e-08 -3.232908418946598e-08 -7.177618761177461e-09 ] [ 1.841869437044707e-08 5.259529937057407e-08 -4.930513819547622e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 17.680058 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.832657558198801e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6399905 1.7531251 1.6121736 ] [ 0.9675797 1.6928431 3.2834046 ] [ 2.0740593 2.4649103 5.2291639 ] [ 2.9852175 4.0559973 1.1983864 ] [ 4.2812493 2.8983123 4.4983437 ] [ 4.5695964 1.212258 2.8664309 ] [ 4.0917254 4.828037 3.1441429 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6399905e-10 1.7531251e-10 1.6121736e-10 ] [ 9.675797e-11 1.6928431e-10 3.2834046e-10 ] [ 2.0740593e-10 2.4649103e-10 5.229163899999999e-10 ] [ 2.9852175e-10 4.0559973e-10 1.1983864e-10 ] [ 4.2812493e-10 2.8983123e-10 4.498343700000001e-10 ] [ 4.5695964e-10 1.212258e-10 2.8664309e-10 ] [ 4.0917254e-10 4.828037000000001e-10 3.1441429e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.2e-06 -1.02e-05 -3.07e-05 ] [ -1.66e-05 -1e-06 6.1e-06 ] [ 6.3e-06 -1.2e-06 3.89e-05 ] [ 3.36e-05 -3.15e-05 2.56e-05 ] [ -3.53e-05 1.01e-05 -7.6e-06 ] [ 1.09e-05 -2.4e-06 -3.05e-05 ] [ 6.4e-06 3.62e-05 -1.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.33131842816e-15 -1.634220153216e-14 -4.918682225856e-14 ] [ -2.659613190528e-14 -1.6021766208e-15 9.77327738688e-15 ] [ 1.009371271104e-14 -1.92261194496e-15 6.232467054911999e-14 ] [ 5.383313445888e-14 -5.04685635552e-14 4.101572149248001e-14 ] [ -5.655683471424e-14 1.618198387008e-14 -1.217654231808e-14 ] [ 1.746372516672e-14 -3.84522388992e-15 -4.88663869344e-14 ] [ 1.025393037312e-14 5.799879367296e-14 -2.88391791744e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.037353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.889902527771674e-18 } }