{ "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" [ [ 0.7315436 0.3767612 1.166558 ] [ 0.6069044 0.5624824 2.9402 ] [ 2.192795 0.1872249 0.2922769 ] [ 2.54678 0.883358 1.224646 ] [ 2.591807 0.3326772 2.854818 ] [ 2.523994 2.504234 0.7585561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.315436e-11 3.767612e-11 1.166558e-10 ] [ 6.069044000000001e-11 5.624824e-11 2.9402e-10 ] [ 2.192795e-10 1.872249e-11 2.922769e-11 ] [ 2.54678e-10 8.83358e-11 1.224646e-10 ] [ 2.591807e-10 3.326772e-11 2.854818e-10 ] [ 2.523994e-10 2.504234e-10 7.585561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.0438617 -3.5099774 -4.0748104 ] [ -8.4469073 0.5083402 12.4266143 ] [ -25.991053 -73.9172777 -104.845734 ] [ 46.5576073 63.3386449 83.9831935 ] [ 6.9722251 -6.6747571 19.1886919 ] [ 1.9519895 20.2550271 -6.6779553 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.371598322708855e-08 -5.62360372981637e-09 -6.528565957072696e-09 ] [ -1.353343739412485e-08 8.144507838527962e-10 1.990963090715896e-08 ] [ -4.16422574665737e-08 -1.184285342041212e-07 -1.679813838054157e-07 ] [ 7.459350993644742e-08 1.014796960519332e-07 1.345559091658225e-07 ] [ 1.117073605017494e-08 -1.069413977513881e-08 3.074367354591433e-08 ] [ 3.127431940947082e-09 3.245213087329042e-08 -1.069926385640745e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 30.456936 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.879739080040187e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3039877 0.9367697 0.7931272 ] [ 0.4325192 0.3082728 3.0763791 ] [ 2.1218686 -0.4364875 -0.1112107 ] [ 3.5741868 0.9663906 1.2784119 ] [ 2.7993617 0.3296776 3.427602 ] [ 1.9619 2.7421145 0.7727454 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.039877000000001e-11 9.367697e-11 7.931272e-11 ] [ 4.325192e-11 3.082728000000001e-11 3.0763791e-10 ] [ 2.1218686e-10 -4.364875e-11 -1.112107e-11 ] [ 3.5741868e-10 9.663906e-11 1.2784119e-10 ] [ 2.7993617e-10 3.296776e-11 3.427602e-10 ] [ 1.9619e-10 2.7421145e-10 7.727454e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.34e-05 2.2e-06 -1.39e-05 ] [ -1.93e-05 -1.22e-05 9.9e-06 ] [ -9e-06 5.9e-06 -1.18e-05 ] [ -1e-06 -8.3e-06 -1.34e-05 ] [ 8.8e-06 3.53e-05 2.6e-06 ] [ 7.2e-06 -2.3e-05 2.67e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.146916671872e-14 3.52478856576e-15 -2.227025502912e-14 ] [ -3.092200878144e-14 -1.954655477376e-14 1.586154854592e-14 ] [ -1.44195895872e-14 9.45284206272e-15 -1.890568412544e-14 ] [ -1.6021766208e-15 -1.329806595264e-14 -2.146916671872e-14 ] [ 1.409915426304e-14 5.655683471424e-14 4.16565921408e-15 ] [ 1.153567166976e-14 -3.68500622784e-14 4.277811577536e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }