{ "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" [ [ 2.166449 2.681347 1.091002 ] [ 2.041583 4.789781 2.041915 ] [ 2.132392 3.124558 3.564623 ] [ 4.758388 2.994993 0.5845722 ] [ 4.303836 3.011562 3.07876 ] [ 3.921174 5.3024 1.134071 ] [ 3.577747 5.183138 3.725421 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.166449e-10 2.681347e-10 1.091002e-10 ] [ 2.041583e-10 4.789780999999999e-10 2.041915e-10 ] [ 2.132392e-10 3.124558e-10 3.564623e-10 ] [ 4.758388e-10 2.994993e-10 5.845722e-11 ] [ 4.303836000000001e-10 3.011562e-10 3.07876e-10 ] [ 3.921174e-10 5.3024e-10 1.134071e-10 ] [ 3.577747e-10 5.183138e-10 3.725421e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4038908 -4.2966243 -2.2770085 ] [ -8.9290856 3.8131534 -0.6793517 ] [ -5.9970871 -3.603821 4.2705685 ] [ -1.2167253 0.7606202 0.9422421 ] [ 6.7489471 -1.8267651 -1.6460743 ] [ 7.6493918 2.3307411 -3.8039367 ] [ 2.1484499 2.8226958 3.1935607 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.471043971162086e-10 -6.883951001821165e-09 -3.648169784062877e-09 ] [ -1.430597219344194e-08 6.109345229004031e-09 -1.088441411040735e-09 ] [ -9.608392744521271e-09 -5.773957751748077e-09 6.842205008224925e-09 ] [ -1.949408829595866e-09 1.21864790174822e-09 1.509638263753496e-09 ] [ 1.081300525863596e-08 -2.926800334913374e-09 -2.637301759559726e-09 ] [ 1.225567670529923e-08 3.734258899557675e-09 -6.094578447743104e-09 ] [ 3.442196200740098e-09 4.522457218390353e-09 5.116648290645682e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.512406 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.004708436315765e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1077513 2.6396811 1.0220419 ] [ 1.686935 4.9915432 1.8561401 ] [ 2.1576091 2.9786443 3.5293668 ] [ 4.5273093 3.0369362 0.8193254 ] [ 4.6714606 2.8503171 3.2683173 ] [ 4.0670683 5.4350817 1.1197303 ] [ 3.6834354 5.1555754 3.6054423 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1077513e-10 2.6396811e-10 1.0220419e-10 ] [ 1.686935e-10 4.9915432e-10 1.8561401e-10 ] [ 2.1576091e-10 2.9786443e-10 3.5293668e-10 ] [ 4.5273093e-10 3.0369362e-10 8.193254e-11 ] [ 4.6714606e-10 2.8503171e-10 3.2683173e-10 ] [ 4.0670683e-10 5.435081699999999e-10 1.1197303e-10 ] [ 3.6834354e-10 5.1555754e-10 3.6054423e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-05 9e-06 6e-07 ] [ -4.1e-06 -1.1e-06 5e-07 ] [ -5.4e-06 -7.9e-06 1.6e-06 ] [ 3e-07 -1e-07 1.3e-06 ] [ -4.4e-06 -0.0 -5.6e-06 ] [ -3.5e-06 -1.02e-05 -1e-07 ] [ 7.2e-06 1.03e-05 1.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-14 1.44195895872e-14 9.6130597248e-16 ] [ -6.568924145279999e-15 -1.76239428288e-15 8.010883104e-16 ] [ -8.65175375232e-15 -1.265719530432e-14 2.56348259328e-15 ] [ 4.8065298624e-16 -1.6021766208e-16 2.08282960704e-15 ] [ -7.04957713152e-15 0.0 -8.972189076479999e-15 ] [ -5.6076181728e-15 -1.634220153216e-14 -1.6021766208e-16 ] [ 1.153567166976e-14 1.650241919424e-14 2.72370025536e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.822485 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.855476879155869e-18 } }