{ "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" [ [ 2.04098 2.133134 3.812884 ] [ 2.161605 4.797503 2.926814 ] [ 2.748178 3.149118 1.513672 ] [ 4.833213 2.247647 2.725743 ] [ 4.087134 1.710162 4.852625 ] [ 4.720686 4.556589 2.507622 ] [ 3.429181 3.830938 4.469304 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04098e-10 2.133134e-10 3.812884e-10 ] [ 2.161605e-10 4.797503e-10 2.926814e-10 ] [ 2.748178e-10 3.149118e-10 1.513672e-10 ] [ 4.833213e-10 2.247647e-10 2.725743e-10 ] [ 4.087134e-10 1.710162e-10 4.852625e-10 ] [ 4.720686e-10 4.556589e-10 2.507622e-10 ] [ 3.429181e-10 3.830938e-10 4.469304000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.682269 1.463065 -3.4893993 ] [ -1.1525191 -0.1172418 -0.7693002 ] [ 2.4824822 -1.2976019 2.6792459 ] [ -3.3554313 0.5480867 0.387661 ] [ 0.6310752 -2.927382 1.0229309 ] [ -2.4667337 0.2900575 -0.2230324 ] [ 3.1788577 2.0410165 0.391894 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.093115440896595e-09 2.344088537710752e-09 -5.590633979095885e-09 ] [ -1.846539157045457e-09 -1.878420709405094e-10 -1.232554794816764e-09 ] [ 3.97737494239215e-09 -2.07898742728566e-09 4.292625142354255e-09 ] [ -5.375993581560551e-09 8.781316969114234e-10 6.211013909959489e-10 ] [ 1.011093931406684e-09 -4.690183000550746e-09 1.638915972673903e-09 ] [ -3.952143063879481e-09 4.647233451876961e-10 -3.573372969609139e-10 ] [ 5.09309148779006e-09 3.270068918967044e-09 6.278834046317952e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -27.054808 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.334658085783281e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2113683 2.2956499 3.544032 ] [ 2.1166399 4.6554429 3.047131 ] [ 2.8855984 3.0939145 1.3685598 ] [ 4.6109946 2.2882129 2.8512084 ] [ 3.9397482 1.5425379 5.0363988 ] [ 4.4398748 4.6482464 2.3763604 ] [ 3.8167528 3.9010865 4.5849736 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2113683e-10 2.2956499e-10 3.544032e-10 ] [ 2.1166399e-10 4.6554429e-10 3.047131e-10 ] [ 2.8855984e-10 3.0939145e-10 1.3685598e-10 ] [ 4.6109946e-10 2.2882129e-10 2.8512084e-10 ] [ 3.9397482e-10 1.5425379e-10 5.0363988e-10 ] [ 4.4398748e-10 4.6482464e-10 2.3763604e-10 ] [ 3.8167528e-10 3.9010865e-10 4.5849736e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6e-06 6.6e-06 -8.4e-06 ] [ -6e-07 7.2e-06 -5.2e-06 ] [ -6.6e-06 3.9e-06 -7.7e-06 ] [ 6.1e-06 -4.6e-06 1.6e-06 ] [ 6.8e-06 8e-07 2.3e-06 ] [ -1.16e-05 -1.5e-05 4.5e-06 ] [ -2e-07 1.2e-06 1.29e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.6130597248e-15 1.057436569728e-14 -1.345828361472e-14 ] [ -9.6130597248e-16 1.153567166976e-14 -8.33131842816e-15 ] [ -1.057436569728e-14 6.24848882112e-15 -1.233675998016e-14 ] [ 9.77327738688e-15 -7.370012455680001e-15 2.56348259328e-15 ] [ 1.089480102144e-14 1.28174129664e-15 3.68500622784e-15 ] [ -1.858524880128e-14 -2.4032649312e-14 7.2097947936e-15 ] [ -3.2043532416e-16 1.92261194496e-15 2.066807840832e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.696935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.757973496641725e-18 } }