{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8760834 0.5811476 0.1887226 ] [ 0.0667642 0.1957144 2.535937 ] [ 2.950388 1.045755 1.267551 ] [ 1.713434 2.554048 0.6359242 ] [ 2.757437 2.623078 2.535254 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.760833999999999e-11 5.811476e-11 1.887226e-11 ] [ 6.67642e-12 1.957144e-11 2.535937e-10 ] [ 2.950388e-10 1.045755e-10 1.267551e-10 ] [ 1.713434e-10 2.554048e-10 6.359242000000001e-11 ] [ 2.757437e-10 2.623078e-10 2.535254e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.7789273 -5.4173706 -2.1879763 ] [ 0.0942519 -0.0677236 -1.2790638 ] [ 9.7191208 -8.7467905 1.5320913 ] [ -5.4719269 9.6030963 -5.8673658 ] [ 2.4374815 4.6287885 7.8023146 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.086103892364471e-08 -8.67958459303856e-09 -3.505524503605774e-09 ] [ 1.510081918901046e-10 -1.085051694903624e-10 -2.049286133755249e-09 ] [ 1.557174824878339e-08 -1.401390336159317e-08 2.454680882014684e-09 ] [ -8.766993422136054e-09 1.538585650591186e-08 -9.400556387890716e-09 ] [ 3.905275905107271e-09 7.416136778427908e-09 1.250068614323705e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -6.4902784 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039857240063491e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.100057 0.7336581 0.8844276 ] [ -0.6005579 -0.3469318 1.997762 ] [ 3.2856801 0.6140231 1.6938465 ] [ 1.2026894 3.0651473 0.8911129 ] [ 3.376238 2.9338462 1.6962398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.100057e-10 7.336581e-11 8.844276e-11 ] [ -6.005579e-11 -3.469318000000001e-11 1.997762e-10 ] [ 3.2856801e-10 6.140231e-11 1.6938465e-10 ] [ 1.2026894e-10 3.0651473e-10 8.911129e-11 ] [ 3.376238e-10 2.9338462e-10 1.6962398e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.1e-06 -7.6e-06 9e-06 ] [ -5e-07 1.5e-06 -5.8e-06 ] [ 1.21e-05 4.8e-06 1e-06 ] [ -4.2e-06 1.23e-05 -2.2e-06 ] [ -2.4e-06 -1.09e-05 -2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.1711008334e-15 -1.21765424184e-14 1.4419589706e-14 ] [ -8.010883169999999e-16 2.403264951e-15 -9.2926244772e-15 ] [ 1.93863372714e-14 7.690447843199998e-15 1.602176634e-15 ] [ -6.729141862799999e-15 1.97067725982e-14 -3.5247885948e-15 ] [ -3.845223921599999e-15 -1.74637253106e-14 -3.204353268e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.077242 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.255422820356342e-18 } }