{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.602926 0.6959513 1.72871 ] [ 2.385594 2.93195 2.226905 ] [ 4.246813 2.107335 1.268583 ] [ 3.789163 4.485736 1.796035 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.602926e-10 6.959513e-11 1.72871e-10 ] [ 2.385594e-10 2.93195e-10 2.226905e-10 ] [ 4.246813000000001e-10 2.107335e-10 1.268583e-10 ] [ 3.789163e-10 4.485736e-10 1.796035e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -42.1036385 -73.0640161 4.8643479 ] [ -694.2864369 -137.5128943 299.5794748 ] [ 311.5760492 475.4799715 -75.173706 ] [ 424.8140262 -264.9030612 -229.2701168 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.745746525531479e-08 -1.170614584171748e-07 7.793544480817576e-09 ] [ -1.112369497339714e-06 -2.203199443060016e-07 4.799792305961028e-07 ] [ 4.991998616294706e-07 7.618028939959503e-07 -1.204415542520927e-07 ] [ 6.806271009655586e-07 -4.244214914329916e-07 -3.673312209850453e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 86.928791 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.392752766146095e-17 } "relaxed-configuration-positions" { "source-value" [ [ 2.5912082 0.6145642 1.7458684 ] [ 1.5016084 3.1522088 2.6346927 ] [ 5.0106427 1.9582735 0.8754324 ] [ 3.9210366 4.4959258 1.7642395 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5912082e-10 6.145642e-11 1.7458684e-10 ] [ 1.5016084e-10 3.1522088e-10 2.6346927e-10 ] [ 5.0106427e-10 1.9582735e-10 8.754324e-11 ] [ 3.9210366e-10 4.4959258e-10 1.7642395e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.8e-06 -2.67e-05 2.9e-06 ] [ 9.3e-06 1.78e-05 -4.6e-06 ] [ 1.3e-06 2.37e-05 -0.0 ] [ -1.8e-06 -1.48e-05 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.409915426304e-14 -4.277811577536e-14 4.646312200320001e-15 ] [ 1.490024257344e-14 2.851874385024e-14 -7.370012455680001e-15 ] [ 2.08282960704e-15 3.797158591296e-14 0.0 ] [ -2.88391791744e-15 -2.371221398784e-14 2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -9.3275482 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.494437965542512e-18 } }