{ "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" [ [ 1.173582 1.448006 2.849718 ] [ 1.983285 3.621531 1.348175 ] [ 2.327062 3.623818 3.682153 ] [ 3.341801 1.495458 1.660386 ] [ 3.963915 2.011825 3.715692 ] [ 4.47485 3.510245 1.32465 ] [ 4.551743 4.234559 4.054178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.173582e-10 1.448006e-10 2.849718e-10 ] [ 1.983285e-10 3.621531e-10 1.348175e-10 ] [ 2.327062e-10 3.623818e-10 3.682153e-10 ] [ 3.341801e-10 1.495458e-10 1.660386e-10 ] [ 3.963915e-10 2.011825e-10 3.715692e-10 ] [ 4.47485e-10 3.510245e-10 1.32465e-10 ] [ 4.551743e-10 4.234559e-10 4.054178000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6410448 1.452055 -0.4363749 ] [ 0.7887767 -0.8313669 0.292264 ] [ -1.7167168 0.1641977 -0.0964821 ] [ -1.2493505 -0.291617 -1.4190559 ] [ 1.0984284 -0.7672076 1.4361672 ] [ -0.9427136 0.1706422 1.1857018 ] [ 0.3805311 0.1032968 -0.9622201 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.629243612245412e-09 2.326448573115745e-09 -6.99149662683938e-10 ] [ 1.263759587771775e-09 -1.331996610486972e-09 4.682585479014912e-10 ] [ -2.750483521494589e-09 2.630737161291322e-10 -1.545813649456877e-10 ] [ -2.001680162284791e-09 -4.672219396278337e-10 -2.273578186588303e-09 ] [ 1.759876302102751e-09 -1.229202080020078e-09 2.300993511399798e-09 ] [ -1.510393690030203e-09 2.733989433618777e-10 1.899703703200477e-09 ] [ 6.096780319073069e-10 1.654997179634534e-10 -1.541646548283838e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -7.938758085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.271929260289116e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6149799 1.7145656 3.0041594 ] [ 1.895799 3.3318956 1.2706028 ] [ 2.32026 3.8999761 3.5133284 ] [ 3.3503595 1.442321 1.3873105 ] [ 3.8739753 1.8815533 3.6379893 ] [ 4.1739385 3.609174 1.7862143 ] [ 4.5869259 4.0659565 4.0353473 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6149799e-10 1.7145656e-10 3.0041594e-10 ] [ 1.895799e-10 3.3318956e-10 1.2706028e-10 ] [ 2.32026e-10 3.8999761e-10 3.5133284e-10 ] [ 3.3503595e-10 1.442321e-10 1.3873105e-10 ] [ 3.8739753e-10 1.8815533e-10 3.6379893e-10 ] [ 4.1739385e-10 3.609174e-10 1.7862143e-10 ] [ 4.5869259e-10 4.0659565e-10 4.0353473e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.78e-05 7.2e-06 2.82e-05 ] [ -1.96e-05 2.69e-05 9.1e-06 ] [ -2.02e-05 2.9e-06 -1.02e-05 ] [ -5e-06 -3.45e-05 -3.36e-05 ] [ 1.21e-05 5e-07 3.9e-06 ] [ 4.7e-05 1.9e-06 1.1e-05 ] [ -3.22e-05 -5e-06 -8.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.851874385024e-14 1.153567166976e-14 4.518138070656001e-14 ] [ -3.140266176767999e-14 4.309855109952001e-14 1.457980724928e-14 ] [ -3.236396774016e-14 4.646312200320001e-15 -1.634220153216e-14 ] [ -8.010883104e-15 -5.52750934176e-14 -5.383313445888e-14 ] [ 1.938633711168e-14 8.010883104e-16 6.24848882112e-15 ] [ 7.530230117759999e-14 3.04413557952e-15 1.76239428288e-14 ] [ -5.159008718975999e-14 -8.010883104e-15 -1.329806595264e-14 ] ] } "relaxed-potential-energy" { "source-value" -9.660528085572459 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.547787224328598e-18 } }