{ "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" [ [ 1.875325 2.956791 1.293332 ] [ 2.112421 5.47429 1.464888 ] [ 2.056962 4.106673 3.914817 ] [ 3.228113 2.011758 3.122182 ] [ 3.602336 4.040974 2.324239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.875325e-10 2.956791e-10 1.293332e-10 ] [ 2.112421e-10 5.47429e-10 1.464888e-10 ] [ 2.056962e-10 4.106673e-10 3.914817000000001e-10 ] [ 3.228113e-10 2.011758e-10 3.122182e-10 ] [ 3.602336e-10 4.040974e-10 2.324239e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.465417 -1.2590467 -2.1369993 ] [ -0.8259843 1.0047535 -0.5806359 ] [ -1.0990305 0.8549355 2.4118477 ] [ 0.0475684 -2.3514236 0.8501095 ] [ 3.3428634 1.7507814 -0.544322 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.347856857122873e-09 -2.017215187235392e-09 -3.423850317125965e-09 ] [ -1.323372734607854e-09 1.609792567366973e-09 -9.302812641771668e-10 ] [ -1.760840972646135e-09 1.369757670391958e-09 3.864205997870252e-09 ] [ 7.621297836886271e-11 -3.76739591751737e-09 1.362025566019977e-09 ] [ 5.355857586007999e-09 2.805061027211493e-09 -8.720999825870977e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -8.8730125 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.421613318356616e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6076862 2.7558281 1.0167316 ] [ 2.0108615 5.0195458 1.6608064 ] [ 2.0520161 4.2673175 4.0338744 ] [ 2.9543051 2.2327089 2.9179854 ] [ 4.250288 4.3150858 2.4900601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6076862e-10 2.7558281e-10 1.0167316e-10 ] [ 2.0108615e-10 5.0195458e-10 1.6608064e-10 ] [ 2.0520161e-10 4.2673175e-10 4.0338744e-10 ] [ 2.9543051e-10 2.2327089e-10 2.9179854e-10 ] [ 4.250288000000001e-10 4.3150858e-10 2.4900601e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.8e-06 6e-07 -3.1e-06 ] [ -1.24e-05 5.4e-06 7e-06 ] [ -2.9e-06 9.9e-06 -6e-07 ] [ 3.7e-06 -3e-06 6e-07 ] [ 1.8e-06 -1.29e-05 -3.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.570133088384e-14 9.6130597248e-16 -4.96674752448e-15 ] [ -1.986699009792e-14 8.65175375232e-15 1.12152363456e-14 ] [ -4.646312200320001e-15 1.586154854592e-14 -9.6130597248e-16 ] [ 5.928053496960001e-15 -4.8065298624e-15 9.6130597248e-16 ] [ 2.88391791744e-15 -2.066807840832e-14 -6.24848882112e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.393797 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.665269855474118e-18 } }