{ "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" [ [ 0.8495841 0.5267621 0.8966685 ] [ 0.1884113 0.623136 2.979456 ] [ 1.483282 2.75051 2.967402 ] [ 1.97645 1.30316 2.052926 ] [ 2.403862 2.938822 1.215589 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.495841e-11 5.267621e-11 8.966685e-11 ] [ 1.884113e-11 6.23136e-11 2.979456e-10 ] [ 1.483282e-10 2.75051e-10 2.967402e-10 ] [ 1.97645e-10 1.30316e-10 2.052926e-10 ] [ 2.403862e-10 2.938822e-10 1.215589e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.9136435 -12.6107777 -16.6095406 ] [ -5.6258804 -1.1253293 5.0445076 ] [ -11.0755481 17.7564716 19.7889104 ] [ 22.1737954 -21.2200076 5.673909 ] [ 9.4412765 17.199643 -13.8977864 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.389429114350598e-08 -2.020469336750826e-08 -2.661141785079434e-08 ] [ -9.013654122558571e-09 -1.802976310015576e-09 8.082192206755418e-09 ] [ -1.774498437456309e-08 2.84490038998046e-08 3.170532985519959e-08 ] [ 3.552633687697668e-08 -3.399820035002241e-08 9.090604423242304e-09 ] [ 1.51265926034333e-08 2.755686612774165e-08 -2.226670863440297e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.4629836 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.343958139845202e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5715162 0.0813776 0.7469312 ] [ 0.0884583 0.8629299 2.9400959 ] [ 1.3248275 2.8964586 3.241512 ] [ 2.3983739 1.0184339 1.9618784 ] [ 2.5184134 3.2831901 1.221624 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.715162e-11 8.13776e-12 7.469312000000001e-11 ] [ 8.84583e-12 8.629299e-11 2.9400959e-10 ] [ 1.3248275e-10 2.8964586e-10 3.241512e-10 ] [ 2.3983739e-10 1.0184339e-10 1.9618784e-10 ] [ 2.5184134e-10 3.2831901e-10 1.221624e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5e-05 -9.5e-06 2.66e-05 ] [ -3.23e-05 8.4e-06 -2.87e-05 ] [ 7.25e-05 2.6e-06 -1.09e-05 ] [ -4.8e-05 -2.94e-05 -6.2e-06 ] [ -4.23e-05 2.79e-05 1.92e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.010883169999999e-14 -1.5220678023e-14 4.26178984644e-14 ] [ -5.17503052782e-14 1.34582837256e-14 -4.598246939579999e-14 ] [ 1.16157805965e-13 4.165659248399999e-15 -1.74637253106e-14 ] [ -7.690447843199999e-14 -4.710399303959999e-14 -9.9334951308e-15 ] [ -6.77720716182e-14 4.470072808859999e-14 3.076179137279999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.407227 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.148074582613392e-18 } }