{ "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" [ [ 2.428537 1.662164 2.065612 ] [ 2.677805 2.654077 4.303636 ] [ 2.380622 3.799595 2.643621 ] [ 4.65403 2.78928 1.862185 ] [ 4.978196 2.955414 4.623231 ] [ 4.975087 5.409268 1.773954 ] [ 3.793479 4.953224 3.972917 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.428537e-10 1.662164e-10 2.065612e-10 ] [ 2.677805e-10 2.654077e-10 4.303636e-10 ] [ 2.380622e-10 3.799595e-10 2.643621e-10 ] [ 4.65403e-10 2.78928e-10 1.862185e-10 ] [ 4.978196e-10 2.955414e-10 4.623231e-10 ] [ 4.975087000000001e-10 5.409268e-10 1.773954e-10 ] [ 3.793479e-10 4.953223999999999e-10 3.972917e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4452786 -8.1952861 -4.5002108 ] [ -1.4458924 -15.4821499 24.623035 ] [ -6.8429156 19.0497037 -20.9508166 ] [ 2.0312244 -0.0525372 -1.1856043 ] [ 3.4413764 -1.5217865 -0.9068944 ] [ -0.1968774 -1.1035034 -0.0209406 ] [ 2.5678058 7.3055594 2.9414316 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.13414962662555e-10 -1.313029579018721e-08 -7.210132532431665e-09 ] [ -2.316574999472402e-09 -2.480513860950106e-08 3.945045101014013e-08 ] [ -1.09635593924276e-08 3.052098990130726e-08 -3.356690854318855e-08 ] [ 3.254380245278507e-09 -8.417387356229377e-11 -1.89954749097995e-09 ] [ 5.513692811452869e-09 -2.438170752149059e-09 -1.453005005214444e-09 ] [ -3.154323674438899e-10 -1.768007348453311e-09 -3.355053974552448e-11 ] [ 4.114078419514641e-09 1.170479647254568e-08 4.712692941202337e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.275821 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.966803340732568e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7732878 1.9209616 2.0450734 ] [ 2.5654798 2.6978764 4.4485387 ] [ 2.0398055 4.317691 2.4207304 ] [ 5.155628 2.5564027 1.9350832 ] [ 5.0965421 2.8144778 4.3889237 ] [ 4.4178234 4.9058842 1.770741 ] [ 3.8391894 5.0097283 4.2360657 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7732878e-10 1.9209616e-10 2.0450734e-10 ] [ 2.5654798e-10 2.6978764e-10 4.4485387e-10 ] [ 2.0398055e-10 4.317691e-10 2.4207304e-10 ] [ 5.155628e-10 2.5564027e-10 1.9350832e-10 ] [ 5.0965421e-10 2.8144778e-10 4.3889237e-10 ] [ 4.4178234e-10 4.905884200000001e-10 1.770741e-10 ] [ 3.8391894e-10 5.0097283e-10 4.2360657e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4e-07 7e-07 2e-07 ] [ 9e-07 -6e-07 -8e-07 ] [ 4e-07 -5e-07 -1.1e-06 ] [ -1.1e-06 0.0 -4e-07 ] [ -2e-07 1e-06 1.2e-06 ] [ -6e-07 -3e-07 1.1e-06 ] [ 1.1e-06 -3e-07 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.408706483200001e-16 1.12152363456e-15 3.2043532416e-16 ] [ 1.44195895872e-15 -9.6130597248e-16 -1.28174129664e-15 ] [ 6.408706483200001e-16 -8.010883104e-16 -1.76239428288e-15 ] [ -1.76239428288e-15 0.0 -6.408706483200001e-16 ] [ -3.2043532416e-16 1.6021766208e-15 1.92261194496e-15 ] [ -9.6130597248e-16 -4.8065298624e-16 1.76239428288e-15 ] [ 1.76239428288e-15 -4.8065298624e-16 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -21.881227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.505759033381772e-18 } }