{ "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" [ [ -17.9638408 -2.58197 -4.5318982 ] [ -7.2828038 1.3505734 9.758701 ] [ -7.67203 -34.0992392 -49.3937091 ] [ 25.0086697 27.3805949 35.4613756 ] [ 7.3320096 -4.1156853 11.8498608 ] [ 0.5779954 12.0657263 -3.1443301 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.878124574953317e-08 -4.136771969606977e-09 -7.260901343885602e-09 ] [ -1.16683379822334e-08 2.163857126154367e-09 1.563516259157758e-08 ] [ -1.229194710007622e-08 -5.46330038333069e-08 -7.913744593461621e-08 ] [ 4.006830591064935e-08 4.386854901237571e-08 5.681538692772757e-08 ] [ 1.174717436460116e-08 -6.594054766230234e-09 1.898556993349438e-08 ] [ 9.260507168099445e-10 1.933142459083168e-08 -5.037772174297725e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 11.601699 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.858797089935874e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3582108 0.7990567 0.5248796 ] [ 0.6846113 1.1259376 2.8833261 ] [ 2.2368017 -0.6056772 0.4595859 ] [ 3.6147886 1.2007365 1.2429636 ] [ 2.5632185 -0.2787845 2.8180306 ] [ 1.736193 2.6054686 1.3082692 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.582108e-11 7.990566999999999e-11 5.248796e-11 ] [ 6.846113000000001e-11 1.1259376e-10 2.8833261e-10 ] [ 2.2368017e-10 -6.056772e-11 4.595859e-11 ] [ 3.6147886e-10 1.2007365e-10 1.2429636e-10 ] [ 2.5632185e-10 -2.787845e-11 2.8180306e-10 ] [ 1.736193e-10 2.6054686e-10 1.3082692e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.83e-05 6e-06 -3.3e-06 ] [ 1.39e-05 -3.16e-05 1.92e-05 ] [ 1.25e-05 -1.27e-05 2.6e-06 ] [ 2.24e-05 3.87e-05 -3.04e-05 ] [ -4.73e-05 -1.71e-05 2.92e-05 ] [ 1.68e-05 1.66e-05 -1.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.931983216064e-14 9.6130597248e-15 -5.28718284864e-15 ] [ 2.227025502912e-14 -5.062878121728e-14 3.076179111936e-14 ] [ 2.002720776e-14 -2.034764308416e-14 4.16565921408e-15 ] [ 3.588875630592e-14 6.200423522496e-14 -4.870616927232e-14 ] [ -7.578295416384e-14 -2.739722021568e-14 4.678355732736e-14 ] [ 2.691656722944e-14 2.659613190528e-14 -2.755743787776e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.411418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.27026967169763e-18 } }