{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.6660422 0.1321237 2.521111 ] [ 1.154832 2.450071 0.6217319 ] [ 0.2052378 1.707228 1.69737 ] [ 2.767871 1.123615 2.427941 ] [ 1.781428 1.004966 1.555643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.660422e-11 1.321237e-11 2.521111e-10 ] [ 1.154832e-10 2.450071e-10 6.217319e-11 ] [ 2.052378e-11 1.707228e-10 1.69737e-10 ] [ 2.767871e-10 1.123615e-10 2.427941e-10 ] [ 1.781428e-10 1.004966e-10 1.555643e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.4328491 -35.8454959 26.4533799 ] [ 15.0092378 37.8085086 -41.1969202 ] [ -60.5487739 10.7019069 19.7549888 ] [ 81.1763333 8.1962703 63.2049212 ] [ -14.203948 -20.8611898 -68.2163697 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.433920974515432e-08 -5.743081549196226e-08 4.238298681692065e-08 ] [ 2.404744989918763e-08 6.057590854623574e-08 -6.600474239340327e-08 ] [ -9.700982996068523e-08 1.71463450331582e-08 3.165098119952585e-08 ] [ 1.300588233755285e-07 1.31318726524174e-08 1.012654470661463e-07 ] [ -2.275723340865892e-08 -3.342331057963142e-08 -1.092946726891895e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 56.157913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.99748952815204e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7980607 0.3321496 2.7407823 ] [ 0.8122453 2.5784927 0.150715 ] [ -0.6770604 2.0224331 1.9070904 ] [ 3.2448098 0.5556724 3.1705671 ] [ 2.3973555 0.9292559 0.8546421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.980607e-11 3.321496e-11 2.7407823e-10 ] [ 8.122453e-11 2.5784927e-10 1.50715e-11 ] [ -6.770604e-11 2.0224331e-10 1.9070904e-10 ] [ 3.2448098e-10 5.556724e-11 3.1705671e-10 ] [ 2.3973555e-10 9.292559000000001e-11 8.546421e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.3e-06 -1.63e-05 -1e-07 ] [ -8.8e-06 1.21e-05 -2.69e-05 ] [ 3.3e-06 5.5e-06 1.53e-05 ] [ -3e-06 2.4e-06 1.1e-06 ] [ 1.17e-05 -3.6e-06 1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28718284864e-15 -2.611547891904e-14 -1.6021766208e-16 ] [ -1.409915426304e-14 1.938633711168e-14 -4.309855109952001e-14 ] [ 5.28718284864e-15 8.8119714144e-15 2.451330229824e-14 ] [ -4.8065298624e-15 3.84522388992e-15 1.76239428288e-15 ] [ 1.874546646336e-14 -5.76783583488e-15 1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.268028 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.805337102411978e-18 } }