{ "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" [ [ 2.791974 1.969692 5.430326 ] [ 0.9772327 1.558703 3.532753 ] [ 1.904195 3.961743 3.08361 ] [ 3.942728 2.452708 3.176311 ] [ 3.885409 4.511937 2.468279 ] [ 3.646129 3.851026 4.717011 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.791974e-10 1.969692e-10 5.430326e-10 ] [ 9.772327e-11 1.558703e-10 3.532753e-10 ] [ 1.904195e-10 3.961743e-10 3.08361e-10 ] [ 3.942728e-10 2.452708e-10 3.176311e-10 ] [ 3.885409e-10 4.511937e-10 2.468279e-10 ] [ 3.646129e-10 3.851026e-10 4.717011000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3200728 -2.0942224 0.0462418 ] [ 2.3447189 1.9542409 1.0156112 ] [ -7.7999312 -0.2073456 -0.5886473 ] [ 3.2558356 -8.0481563 -3.0222659 ] [ 3.1834334 4.7243193 -5.2037733 ] [ 1.3360161 3.6711641 7.7528334 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.717166398713994e-09 -3.355314168035666e-09 7.408753086370945e-11 ] [ 3.756653803927893e-09 3.131039081391151e-09 1.627188520462633e-09 ] [ -1.249686741248849e-08 -3.322042727457484e-10 -9.43116941957044e-10 ] [ 5.216423679488341e-09 -1.289456786440423e-08 -4.842203766821071e-09 ] [ 5.100422567353856e-09 7.569193931654222e-09 -8.337363921203265e-09 ] [ 2.140533760432395e-09 5.881853292140273e-09 1.242140841843738e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.6806782 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.070362642312823e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.1354759 2.0167207 5.1998491 ] [ 1.4773482 1.9196965 3.4071258 ] [ 1.5447083 4.1936281 3.2216849 ] [ 3.8599622 1.8055917 2.8753957 ] [ 3.9273012 4.0795155 2.6898749 ] [ 3.2028718 4.2906565 5.0143596 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.1354759e-10 2.0167207e-10 5.1998491e-10 ] [ 1.4773482e-10 1.9196965e-10 3.4071258e-10 ] [ 1.5447083e-10 4.1936281e-10 3.2216849e-10 ] [ 3.8599622e-10 1.8055917e-10 2.8753957e-10 ] [ 3.9273012e-10 4.079515500000001e-10 2.6898749e-10 ] [ 3.2028718e-10 4.2906565e-10 5.0143596e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -9.9e-06 7.41e-05 1.52e-05 ] [ -2.05e-05 -1.62e-05 3.15e-05 ] [ 3.8e-06 -2.17e-05 -1.6e-05 ] [ -8.5e-06 2e-07 -4.44e-05 ] [ 4.64e-05 3.16e-05 -1.01e-05 ] [ -1.14e-05 -6.8e-05 2.38e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.586154854592e-14 1.1872128760128e-13 2.435308463616e-14 ] [ -3.28446207264e-14 -2.595526125696e-14 5.04685635552e-14 ] [ 6.08827115904e-15 -3.476723267136e-14 -2.56348259328e-14 ] [ -1.36185012768e-14 3.2043532416e-16 -7.113664196352e-14 ] [ 7.434099520512001e-14 5.062878121728e-14 -1.618198387008e-14 ] [ -1.826481347712e-14 -1.089480102144e-13 3.813180357504e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.567729 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853354495955016e-18 } }