{ "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" [ [ 1.497272 0.041495 0.0459008 ] [ 0.5144624 2.623314 0.1336692 ] [ 0.1881884 1.665255 2.217108 ] [ 2.303156 0.3070008 2.474488 ] [ 2.009269 2.269424 0.9602388 ] [ 2.927445 2.103094 2.701001 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.497272e-10 4.1495e-12 4.59008e-12 ] [ 5.144624e-11 2.623314e-10 1.336692e-11 ] [ 1.881884e-11 1.665255e-10 2.217108e-10 ] [ 2.303156e-10 3.070008e-11 2.474488e-10 ] [ 2.009269e-10 2.269424e-10 9.602388e-11 ] [ 2.927445e-10 2.103094e-10 2.701001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4150053 7.5812843 6.4964185 ] [ -257.1277205 57.0886117 -139.6425127 ] [ 8.6101291 -0.7244743 -4.3343331 ] [ -27.3855958 -59.7643973 -14.5023163 ] [ 237.6289494 -64.9386348 110.1954591 ] [ 37.8592325 60.7576104 41.7872845 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.649117891680902e-10 1.214655646109809e-08 1.04084098396326e-08 ] [ -4.119640223446969e-07 9.146603897966935e-08 -2.237319691177071e-07 ] [ 1.379494754608975e-08 -1.160735785830445e-09 -6.944367159579589e-09 ] [ -4.387656133743867e-08 -9.575312011026266e-08 -2.323527212330676e-08 ] [ 3.807235471539462e-07 -1.040431624632293e-07 1.765525882883426e-07 ] [ 6.065717719293153e-08 9.734442291855494e-08 6.695061027261822e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.802689 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.211434561997333e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0635753 0.3602724 0.3491593 ] [ 0.3666197 2.4522351 0.099823 ] [ 0.6462302 1.617627 2.1254008 ] [ 2.3919217 0.2528369 2.1177948 ] [ 2.4142972 2.0515377 0.8238318 ] [ 2.5571487 2.2750737 3.0163961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0635753e-10 3.602724e-11 3.491593e-11 ] [ 3.666197e-11 2.4522351e-10 9.9823e-12 ] [ 6.462302e-11 1.617627e-10 2.1254008e-10 ] [ 2.3919217e-10 2.528369e-11 2.1177948e-10 ] [ 2.4142972e-10 2.0515377e-10 8.238318e-11 ] [ 2.5571487e-10 2.2750737e-10 3.0163961e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.52e-05 -0.0001011 8.2e-06 ] [ 7.29e-05 -4.69e-05 -4.33e-05 ] [ -4.23e-05 6.09e-05 2.53e-05 ] [ 3.3e-06 0.0001083 -0.0001125 ] [ -6.26e-05 3.06e-05 -2.5e-06 ] [ 6.38e-05 -5.17e-05 0.0001247 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.639661705216e-14 -1.6198005636288e-13 1.313784829056e-14 ] [ 1.1679867565632e-13 -7.514208351552e-14 -6.937424768064e-14 ] [ -6.777207105984e-14 9.757255620672e-14 4.053506850624e-14 ] [ 5.28718284864e-15 1.7351572803264e-13 -1.8024486984e-13 ] [ -1.0029625646208e-13 4.902660459647999e-14 -4.005441552e-15 ] [ 1.0221886840704e-13 -8.283253129536002e-14 1.9979142461376e-13 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }