{ "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" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6308227 -0.2975963 0.164021 ] [ 2.0962823 0.4123486 1.487072 ] [ 0.2586552 -0.5746828 0.4271752 ] [ 1.3319017 1.1288457 -1.0951031 ] [ -1.2819089 -0.5263102 0.245196 ] [ -0.5838338 -0.617716 -1.2765956 ] [ -0.1902738 0.475111 0.0482345 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.612866002609933e-09 -4.76801834296583e-10 2.627906115202368e-10 ] [ 3.358614491656852e-09 6.606552865396109e-10 2.382551991846298e-09 ] [ 4.144113142883481e-10 -9.207433465358824e-10 6.844101184255642e-10 ] [ 2.133941764943775e-09 1.808610189030611e-09 -1.754548584185604e-09 ] [ -2.053844469575445e-09 -8.43241897728572e-10 3.928472987136768e-10 ] [ -9.35404864792823e-10 -9.896901334940929e-10 -2.045331624536149e-09 ] [ -3.04852233910775e-10 7.612117364849088e-10 7.72801882159776e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -7.429157085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.190282179475486e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5683267 1.168886 2.2826168 ] [ 2.8621196 0.9875718 1.9039016 ] [ 1.819753 2.8666534 3.2772754 ] [ 1.7748886 0.4716987 4.15236 ] [ 4.1009003 0.3904964 3.8121898 ] [ 3.1251035 2.1496577 5.0978994 ] [ 4.1429122 2.6326021 2.992987 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.683267e-11 1.168886e-10 2.2826168e-10 ] [ 2.8621196e-10 9.875718e-11 1.9039016e-10 ] [ 1.819753e-10 2.8666534e-10 3.2772754e-10 ] [ 1.7748886e-10 4.716987000000001e-11 4.15236e-10 ] [ 4.1009003e-10 3.904964e-11 3.8121898e-10 ] [ 3.1251035e-10 2.1496577e-10 5.0978994e-10 ] [ 4.1429122e-10 2.6326021e-10 2.992987e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.34e-05 3.18e-05 1.72e-05 ] [ -7.6e-06 -2.7e-05 -1.76e-05 ] [ -3.66e-05 2.32e-05 -1.7e-06 ] [ -2.66e-05 -3.19e-05 -1.49e-05 ] [ 6.03e-05 3.41e-05 2.41e-05 ] [ -1.37e-05 -1.14e-05 2.3e-06 ] [ 3.76e-05 -1.89e-05 -9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.146916671872e-14 5.094921654144e-14 2.755743787776e-14 ] [ -1.217654231808e-14 -4.32587687616e-14 -2.819830852608e-14 ] [ -5.863966432128e-14 3.717049760256e-14 -2.72370025536e-15 ] [ -4.261789811328e-14 -5.110943420352001e-14 -2.387243164992e-14 ] [ 9.661125023424001e-14 5.463422276928e-14 3.861245656128e-14 ] [ -2.194981970496e-14 -1.826481347712e-14 3.68500622784e-15 ] [ 6.024184094208e-14 -3.028113813312e-14 -1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.660528085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.547787224328598e-18 } }