{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.2934362 2.840867 1.110891 ] [ 0.7634727 2.370483 2.358735 ] [ 2.954483 0.5132865 0.5514058 ] [ 1.977096 2.170821 0.0967804 ] [ 2.774594 2.595093 2.624283 ] [ 2.05175 1.547661 1.964386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.934362e-11 2.840867e-10 1.110891e-10 ] [ 7.634727e-11 2.370483e-10 2.358735e-10 ] [ 2.954483e-10 5.132865e-11 5.514058e-11 ] [ 1.977096e-10 2.170821e-10 9.67804e-12 ] [ 2.774594e-10 2.595093e-10 2.624283e-10 ] [ 2.05175e-10 1.547661e-10 1.964386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -60.537222 46.9106037 -67.2667983 ] [ -21.1427128 0.9914907 62.0647818 ] [ 8.7934043 -13.260158 -5.1847544 ] [ -1.0117287 8.4547471 -18.020494 ] [ 39.0955747 44.1346485 32.6625408 ] [ 34.8026843 -87.231332 -4.2552759 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.699132177657942e-08 7.515907251575398e-08 -1.077732915923292e-07 ] [ -3.387436014844891e-08 1.588543219280627e-09 9.943874237501334e-08 ] [ 1.408858678670219e-08 -2.124511513571409e-08 -8.306892284269931e-09 ] [ -1.620968069732377e-09 1.35459981383966e-08 -2.887201418206668e-08 ] [ 6.263801576107998e-08 7.071150199392579e-08 5.233115924568614e-08 ] [ 5.576004712654322e-08 -1.397600007316429e-07 -6.817703562033679e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 45.663859 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.316156730530767e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3582369 2.5727163 0.2496442 ] [ 0.4763554 2.5124638 2.2944352 ] [ 2.8659576 1.242078 0.433687 ] [ 1.2528687 1.7174211 -0.9997417 ] [ 4.0099874 2.1597259 4.1821896 ] [ 2.5678996 1.8338064 2.5462669 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.582369e-11 2.5727163e-10 2.496442e-11 ] [ 4.763554e-11 2.5124638e-10 2.2944352e-10 ] [ 2.865957600000001e-10 1.242078e-10 4.33687e-11 ] [ 1.2528687e-10 1.7174211e-10 -9.997417e-11 ] [ 4.0099874e-10 2.1597259e-10 4.1821896e-10 ] [ 2.5678996e-10 1.8338064e-10 2.5462669e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0316793 -0.0338708 0.1007874 ] [ -0.2299442 0.089547 -0.1056337 ] [ -0.072668 0.0113041 -0.230995 ] [ 0.0960257 -0.0630847 0.0920893 ] [ -0.2227634 -0.1189741 -0.2096492 ] [ 0.3976706 0.1150786 0.3534013 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.075583382330945e-11 -5.426700388779264e-11 1.614792159512179e-10 ] [ -3.684112213285593e-10 1.434701098627776e-10 -1.69243844508601e-10 ] [ -1.164269706802944e-10 1.811116473918528e-11 -3.70094788521696e-10 ] [ 1.538501315359546e-10 -1.010728314701817e-10 1.475433234858374e-10 ] [ -3.569063114499187e-10 -1.906175215007213e-10 -3.358950468094234e-10 ] [ 6.371385380995084e-10 1.843762424743949e-10 5.662113006203271e-10 ] ] } "relaxed-potential-energy" { "source-value" -13.729238 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.199666414499895e-18 } }