{ "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" [ [ 2.845445 0.9973996 1.833851 ] [ 2.258239 2.496991 3.58031 ] [ 1.78294 4.270758 1.69672 ] [ 2.678494 4.477221 3.72616 ] [ 4.64173 2.41566 3.489752 ] [ 3.528967 5.47506 1.628646 ] [ 3.443776 3.131475 0.8054665 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.845445e-10 9.973996000000001e-11 1.833851e-10 ] [ 2.258239e-10 2.496991e-10 3.58031e-10 ] [ 1.78294e-10 4.270758e-10 1.69672e-10 ] [ 2.678494e-10 4.477221e-10 3.72616e-10 ] [ 4.64173e-10 2.41566e-10 3.489752e-10 ] [ 3.528967e-10 5.475060000000001e-10 1.628646e-10 ] [ 3.443776e-10 3.131475e-10 8.054665e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.3954322 1.0552824 0.3268712 ] [ -8.1639727 -23.6190644 0.2756978 ] [ -22.1078517 -4.4954087 -4.3650005 ] [ 7.1714912 22.9381428 11.5826863 ] [ 3.2448594 0.3228105 -0.1898596 ] [ 12.9905707 11.0448103 -0.5908266 ] [ 7.2603353 -7.2465728 -7.0395686 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.335522259515098e-10 1.690748789621714e-09 5.237053946528409e-10 ] [ -1.308012619278945e-08 -3.784191278684958e-08 4.417165695659942e-10 ] [ -3.542068312985354e-08 -7.202438720080921e-09 -6.993501750880311e-09 ] [ 1.148999553691294e-08 3.675095611873185e-08 1.855750919592046e-08 ] [ 5.198837868463116e-09 5.171994360487584e-10 -3.041886123544397e-10 ] [ 2.081318866638949e-08 1.769573684383103e-08 -9.466085654667532e-10 ] [ 1.163233947682896e-08 -1.16102895210852e-08 -1.127863223143779e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5334899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.527433463241293e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1329117 1.2755815 2.3889967 ] [ 1.3812911 2.6816487 3.4118378 ] [ 1.4119204 4.0421698 1.3528368 ] [ 3.1861607 4.1274137 4.2741835 ] [ 4.9247948 3.0203318 2.7994108 ] [ 3.5918784 5.1630848 1.9968616 ] [ 3.550634 2.9543342 0.5367783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.132911700000001e-10 1.2755815e-10 2.3889967e-10 ] [ 1.3812911e-10 2.6816487e-10 3.4118378e-10 ] [ 1.4119204e-10 4.0421698e-10 1.3528368e-10 ] [ 3.1861607e-10 4.1274137e-10 4.274183500000001e-10 ] [ 4.9247948e-10 3.0203318e-10 2.7994108e-10 ] [ 3.5918784e-10 5.1630848e-10 1.9968616e-10 ] [ 3.550634e-10 2.9543342e-10 5.367783e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.9e-05 1.2e-06 3.1e-06 ] [ -5.3e-05 5.25e-05 -5e-07 ] [ -1.3e-06 -5.4e-06 6.7e-06 ] [ 2.8e-06 -4.5e-05 -2.49e-05 ] [ 4.5e-06 -1.77e-05 -2.63e-05 ] [ -1.28e-05 1.7e-06 -1.28e-05 ] [ 7e-07 1.26e-05 5.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.45284206272e-14 1.92261194496e-15 4.96674752448e-15 ] [ -8.49153609024e-14 8.4114272592e-14 -8.010883104e-16 ] [ -2.08282960704e-15 -8.65175375232e-15 1.073458335936e-14 ] [ 4.48609453824e-15 -7.209794793600001e-14 -3.989419785791999e-14 ] [ 7.2097947936e-15 -2.835852618816e-14 -4.213724512704e-14 ] [ -2.050786074624e-14 2.72370025536e-15 -2.050786074624e-14 ] [ 1.12152363456e-15 2.018742542208e-14 8.779927881984e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }