{ "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" [ [ 2.019678 3.528357 2.55152 ] [ 4.681874 1.030316 1.978031 ] [ 3.876194 2.698932 0.9098523 ] [ 3.736168 1.84025 3.911189 ] [ 5.498325 3.105138 2.775129 ] [ 3.884183 4.867643 2.227305 ] [ 3.327521 4.019973 4.190113 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.019678e-10 3.528357e-10 2.55152e-10 ] [ 4.681874e-10 1.030316e-10 1.978031e-10 ] [ 3.876194e-10 2.698932e-10 9.098523e-11 ] [ 3.736168e-10 1.84025e-10 3.911189e-10 ] [ 5.498325e-10 3.105138e-10 2.775129000000001e-10 ] [ 3.884183e-10 4.867643e-10 2.227305e-10 ] [ 3.327521e-10 4.019973e-10 4.190113e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -21.2800373 -1.0019309 -6.4676553 ] [ 1.6331048 -13.5492404 -4.1533642 ] [ -5.3739772 -1.4714132 -26.4709395 ] [ -2.978243 -16.8636733 21.4088935 ] [ 27.7128567 5.9781308 2.6912864 ] [ 5.8595024 18.94463 -7.0050065 ] [ -5.5732064 7.963497 19.9967856 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.409437825181196e-08 -1.605270263637103e-09 -1.036232611305321e-08 ] [ 2.61652232987626e-09 -2.170827619847884e-08 -6.654423018907696e-09 ] [ -8.610060630552245e-09 -2.357463828576515e-09 -4.241112039751125e-08 ] [ -4.771671305661254e-09 -2.701858310206918e-08 3.430082864289708e-08 ] [ 4.440089110032064e-08 9.5780214038444e-09 4.311916149956997e-09 ] [ 9.387957754801489e-09 3.035264327570631e-08 -1.122325764285204e-08 ] [ -8.929260996972935e-09 1.275892871321094e-08 3.20383823794701e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.370818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.982023537977181e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6895513 3.5779791 1.9400312 ] [ 4.7708423 1.4903349 2.1787953 ] [ 2.9533155 1.9720075 0.7441504 ] [ 3.7534782 1.6972568 4.3027603 ] [ 6.1121055 3.4372547 2.1144687 ] [ 4.8483368 5.043257 3.3102978 ] [ 2.8963134 3.8725191 3.9526356 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6895513e-10 3.5779791e-10 1.9400312e-10 ] [ 4.7708423e-10 1.4903349e-10 2.1787953e-10 ] [ 2.9533155e-10 1.9720075e-10 7.441504e-11 ] [ 3.7534782e-10 1.6972568e-10 4.3027603e-10 ] [ 6.112105500000001e-10 3.4372547e-10 2.1144687e-10 ] [ 4.8483368e-10 5.043257e-10 3.3102978e-10 ] [ 2.8963134e-10 3.8725191e-10 3.9526356e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.29e-05 -2.02e-05 -2.33e-05 ] [ 2.71e-05 1.67e-05 1.3e-06 ] [ -2.1e-05 -6.4e-06 1.44e-05 ] [ -2.58e-05 1.34e-05 -1.22e-05 ] [ -2.6e-06 -1.87e-05 -1.94e-05 ] [ 9.2e-06 2.07e-05 3.93e-05 ] [ 2.61e-05 -5.7e-06 -2e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.066807840832e-14 -3.236396774016e-14 -3.733071526464e-14 ] [ 4.341898642368e-14 2.675634956736e-14 2.08282960704e-15 ] [ -3.36457090368e-14 -1.025393037312e-14 2.307134333952e-14 ] [ -4.133615681664e-14 2.146916671872e-14 -1.954655477376e-14 ] [ -4.16565921408e-15 -2.996070280896e-14 -3.108222644352e-14 ] [ 1.474002491136e-14 3.316505605055999e-14 6.296554119743999e-14 ] [ 4.181680980288e-14 -9.13240673856e-15 -3.2043532416e-16 ] ] } "relaxed-potential-energy" { "source-value" -16.893559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.706646527190543e-18 } }