{ "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" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2255004 -1.8836531 -0.2618671 ] [ -0.1487761 -0.0482154 0.901254 ] [ -1.5822181 1.5638768 0.6318931 ] [ 0.0748391 0.5566559 -0.7105049 ] [ -0.2618819 0.5934372 0.1521415 ] [ 1.1344846 -1.19304 -2.1828034 ] [ 1.0090528 0.4109385 1.4698868 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.612914688610483e-10 -3.017944958517445e-09 -4.195573453766957e-10 ] [ -2.383655891538029e-10 -7.724958664252032e-11 1.443968088202483e-09 ] [ -2.534992848826597e-09 2.505606846771518e-09 1.012404351664837e-09 ] [ 1.199054563417133e-10 8.918610688103826e-10 -1.138354339743842e-09 ] [ -4.195810575906836e-10 9.507912077530137e-10 2.437575543534432e-10 ] [ 1.81764470277764e-09 -1.911460795679232e-09 -3.497236575282751e-09 ] [ 1.616680805312779e-09 6.583960572866208e-10 2.355018266182526e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.7627571589289275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.083513141218376e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5694023 1.5836758 3.2680772 ] [ 1.7882428 3.2329313 1.6659306 ] [ 2.816043 5.1800622 2.7906809 ] [ 1.5388664 3.5851591 4.1003672 ] [ 4.9416765 1.7761596 2.9670287 ] [ 4.187406 3.6042156 1.608851 ] [ 3.9984562 3.5515863 4.2093044 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5694023e-10 1.5836758e-10 3.2680772e-10 ] [ 1.7882428e-10 3.2329313e-10 1.6659306e-10 ] [ 2.816043e-10 5.180062200000001e-10 2.7906809e-10 ] [ 1.5388664e-10 3.5851591e-10 4.1003672e-10 ] [ 4.9416765e-10 1.7761596e-10 2.9670287e-10 ] [ 4.187406e-10 3.6042156e-10 1.608851e-10 ] [ 3.998456200000001e-10 3.5515863e-10 4.2093044e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.25e-05 1.02e-05 -1.47e-05 ] [ 7.8e-06 -1.25e-05 1.7e-05 ] [ -1.45e-05 1.3e-05 -1.83e-05 ] [ 1.48e-05 1.2e-06 -5.2e-06 ] [ -2.79e-05 6.4e-06 -8.6e-06 ] [ 3.6e-06 -5.4e-06 1.47e-05 ] [ 3.7e-06 -1.29e-05 1.51e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.002720776e-14 1.634220153216e-14 -2.355199632576e-14 ] [ 1.249697764224e-14 -2.002720776e-14 2.72370025536e-14 ] [ -2.32315610016e-14 2.08282960704e-14 -2.931983216064e-14 ] [ 2.371221398784e-14 1.92261194496e-15 -8.33131842816e-15 ] [ -4.470072772032e-14 1.025393037312e-14 -1.377871893888e-14 ] [ 5.76783583488e-15 -8.65175375232e-15 2.355199632576e-14 ] [ 5.928053496960001e-15 -2.066807840832e-14 2.419286697408e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }