{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6237477 -1.2822461 0.5592589 ] [ 0.0114896 0.7125188 0.2583214 ] [ 2.0350712 1.3721789 0.6430108 ] [ 0.6827815 -1.08133 -1.0538361 ] [ 0.8718428 -0.1960448 -1.1585842 ] [ -0.1340538 1.313021 0.1091787 ] [ -1.8433836 -0.8380979 0.6426505 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.601530603017772e-09 -2.054384723531979e-09 8.960315345543252e-10 ] [ 1.840836850234368e-11 1.141580963240471e-09 4.138765077323251e-10 ] [ 3.260543498303401e-09 2.198472953135061e-09 1.030216870681905e-09 ] [ 1.093936556414755e-09 -1.732481645369664e-09 -1.688431561575051e-09 ] [ 1.39684615117281e-09 -3.140983951894119e-10 -1.856256518468271e-09 ] [ -2.147778642893991e-10 2.103691548819437e-09 1.74923560629337e-10 ] [ -2.953426107086139e-09 -1.342780861321576e-09 1.02963960644543e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.839735085572457 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.256064026736968e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1960445 2.3570067 2.7471222 ] [ 2.301643 1.4661383 4.5462434 ] [ 2.5903804 3.8698176 1.7371409 ] [ 2.4787346 3.85417 4.1600454 ] [ 3.5312877 1.7599566 2.4762763 ] [ 4.379255 2.4284117 4.6482215 ] [ 4.5577227 3.913935 2.9120713 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1960445e-10 2.3570067e-10 2.7471222e-10 ] [ 2.301643e-10 1.4661383e-10 4.5462434e-10 ] [ 2.5903804e-10 3.8698176e-10 1.7371409e-10 ] [ 2.4787346e-10 3.85417e-10 4.1600454e-10 ] [ 3.5312877e-10 1.7599566e-10 2.4762763e-10 ] [ 4.379255e-10 2.4284117e-10 4.6482215e-10 ] [ 4.557722700000001e-10 3.913935e-10 2.9120713e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.07e-05 -9.2e-06 -7.5e-06 ] [ -1e-07 1.14e-05 2.5e-05 ] [ 3.3e-06 3.39e-05 6.9e-06 ] [ -2.6e-05 2.94e-05 -2.89e-05 ] [ 1.67e-05 -5.35e-05 1.24e-05 ] [ 2.93e-05 -3.62e-05 -3.52e-05 ] [ -1.25e-05 2.42e-05 2.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.714328984256e-14 -1.474002491136e-14 -1.2016324656e-14 ] [ -1.6021766208e-16 1.826481347712e-14 4.005441552e-14 ] [ 5.28718284864e-15 5.431378744512e-14 1.105501868352e-14 ] [ -4.16565921408e-14 4.710399265152e-14 -4.630290434112001e-14 ] [ 2.675634956736e-14 -8.57164492128e-14 1.986699009792e-14 ] [ 4.694377498944e-14 -5.799879367296e-14 -5.639661705216e-14 ] [ -2.002720776e-14 3.877267422336e-14 4.373942174784e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.821491085572458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.573576339869981e-18 } }