{ "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" [ [ 2.719922 0.6324479 2.001085 ] [ 1.570016 2.535953 2.950979 ] [ 1.512501 2.471908 5.050939 ] [ 3.556391 2.380181 1.668166 ] [ 3.168972 1.023761 5.396195 ] [ 4.64835 1.331065 3.67677 ] [ 3.603196 3.529371 4.833641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.719922e-10 6.324478999999999e-11 2.001085e-10 ] [ 1.570016e-10 2.535953e-10 2.950979e-10 ] [ 1.512501e-10 2.471908e-10 5.050939e-10 ] [ 3.556391e-10 2.380181e-10 1.668166e-10 ] [ 3.168972e-10 1.023761e-10 5.396195e-10 ] [ 4.64835e-10 1.331065e-10 3.67677e-10 ] [ 3.603196e-10 3.529371e-10 4.833641e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.0944185 -10.130382 1.1708303 ] [ -2.0665152 0.6459269 -3.1915012 ] [ -1.2346834 1.1192544 3.7746866 ] [ 5.636179 9.3600729 -2.5679861 ] [ 1.0482824 -1.3911224 0.4543865 ] [ 0.4373838 -0.2927112 -0.0224302 ] [ 0.2737718 0.6889614 0.3820141 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.559981650517327e-09 -1.623066133389419e-08 1.87587694903921e-09 ] [ -3.310922367245836e-09 1.034888986452054e-09 -5.11334865002296e-09 ] [ -1.978180893867676e-09 1.793243247181689e-09 6.047714671192904e-09 ] [ 9.030154298841486e-09 1.499649009291662e-08 -4.114367325856788e-09 ] [ 1.679533567113441e-09 -2.228823804314001e-09 7.28007433105041e-10 ] [ 7.007661044501291e-10 -4.689750451501007e-10 -3.59371423359468e-11 ] [ 4.386307810081212e-10 1.103837856807927e-09 6.120540648785394e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -10.770131 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.725565223331905e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.4120445 0.1178758 0.8163006 ] [ 1.562071 3.1955993 2.8022319 ] [ 2.5855737 3.0275457 4.854669 ] [ 1.9802756 1.9067548 0.9497023 ] [ 3.491789 1.0237501 5.5268969 ] [ 5.0443668 -0.2301684 4.3933255 ] [ 2.7032275 4.8633297 6.2346489 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4120445e-10 1.178758e-11 8.163006e-11 ] [ 1.562071e-10 3.1955993e-10 2.8022319e-10 ] [ 2.5855737e-10 3.0275457e-10 4.854669e-10 ] [ 1.9802756e-10 1.9067548e-10 9.497023e-11 ] [ 3.491789e-10 1.0237501e-10 5.526896899999999e-10 ] [ 5.0443668e-10 -2.301684e-11 4.393325500000001e-10 ] [ 2.7032275e-10 4.8633297e-10 6.2346489e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.93e-05 5.46e-05 -1.19e-05 ] [ 9.4e-06 -3.22e-05 -6.69e-05 ] [ 2.79e-05 9.7e-06 7.4e-06 ] [ 2.3e-06 4.6e-06 3.5e-05 ] [ 2.2e-06 9.19e-05 1.81e-05 ] [ 3.9e-05 -8.11e-05 2.36e-05 ] [ -3.14e-05 -4.74e-05 -5.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.89873080562e-14 8.74788442164e-14 -1.90659019446e-14 ] [ 1.50604603596e-14 -5.159008761479998e-14 -1.071856168146e-13 ] [ 4.470072808859999e-14 1.55411133498e-14 1.18561070916e-14 ] [ 3.685006258199999e-15 7.370012516399999e-15 5.607618218999999e-14 ] [ 3.5247885948e-15 1.472400326646e-13 2.899939707539999e-14 ] [ 6.248488872599999e-14 -1.299365250174e-13 3.78113685624e-14 ] [ -5.030834630759999e-14 -7.59431724516e-14 -8.4915361602e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.90775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.54870253495135e-18 } }