{ "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" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8079725 -0.7173951 -0.652448 ] [ -35.5098219 -14.448462 23.7485263 ] [ -8.4688439 1.5847649 2.8306699 ] [ 3.1395724 9.5666788 -19.2976111 ] [ 34.2264123 -10.4014854 -11.2794498 ] [ 7.4206536 14.4158988 4.6503127 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.294514660414565e-09 -1.149393666566093e-09 -1.045336940500032e-09 ] [ -5.689300692568147e-08 -2.314898821363691e-08 3.804933392979447e-08 ] [ -1.356858381357343e-08 2.539073293163346e-09 4.535233172347117e-09 ] [ 5.030149540031301e-09 1.532750923834316e-08 -3.091818159643904e-08 ] [ 5.483675805271019e-08 -1.666501686677214e-08 -1.807167091393597e-08 ] [ 1.188919780692798e-08 2.309681621546864e-08 7.45062234873345e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 8.9734173 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.437699952519137e-18 } "relaxed-configuration-positions" { "source-value" [ [ -1.3312481 1.3848329 1.4371708 ] [ 0.7920155 0.1127905 1.7648408 ] [ 0.324415 2.1694957 3.1332935 ] [ 4.2378327 0.8144797 -0.4933936 ] [ 3.0041201 0.9269609 1.438795 ] [ 2.5652184 2.8574379 2.7232721 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.3312481e-10 1.3848329e-10 1.4371708e-10 ] [ 7.920155e-11 1.127905e-11 1.7648408e-10 ] [ 3.24415e-11 2.1694957e-10 3.1332935e-10 ] [ 4.2378327e-10 8.144797e-11 -4.933936e-11 ] [ 3.0041201e-10 9.269609e-11 1.438795e-10 ] [ 2.5652184e-10 2.8574379e-10 2.7232721e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.45e-05 1.68e-05 2.32e-05 ] [ 3.31e-05 -7.5e-06 -1.63e-05 ] [ 3.5e-06 4e-06 -2.25e-05 ] [ 4.4e-06 8.4e-06 -1.31e-05 ] [ -3.9e-05 -3.2e-06 4.6e-05 ] [ -1.64e-05 -1.85e-05 -1.72e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.3231561193e-14 2.691656745119999e-14 3.71704979088e-14 ] [ 5.303204658539999e-14 -1.2016324755e-14 -2.61154791342e-14 ] [ 5.607618218999999e-15 6.408706535999999e-15 -3.6048974265e-14 ] [ 7.0495771896e-15 1.34582837256e-14 -2.09885139054e-14 ] [ -6.248488872599999e-14 -5.1269652288e-15 7.370012516399999e-14 ] [ -2.62756967976e-14 -2.9640267729e-14 -2.75574381048e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.812132 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.212947515612369e-18 } }