{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.223645 0.1945873 1.126976 ] [ 0.7288277 2.388611 0.0814776 ] [ 2.404153 0.5300895 0.5572584 ] [ 2.145602 0.6403931 2.690423 ] [ 2.26761 2.998114 1.480003 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.23645e-11 1.945873e-11 1.126976e-10 ] [ 7.288277e-11 2.388611e-10 8.14776e-12 ] [ 2.404153e-10 5.300895e-11 5.572584000000001e-11 ] [ 2.145602e-10 6.403931000000001e-11 2.690423e-10 ] [ 2.26761e-10 2.998114e-10 1.480003e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.6027478 0.7007419 0.6463891 ] [ -1.4594311 -2.391679 -1.1594272 ] [ 1.1969545 2.2163579 -3.5081613 ] [ -1.1517076 1.7209549 1.8735653 ] [ 2.016932 -2.2463757 2.147634 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.65708433398634e-10 1.122712289394972e-09 1.035629503959953e-09 ] [ -2.338266388088427e-09 -3.831892178258323e-09 -1.857607153359606e-09 ] [ 1.917732516061354e-09 3.550996810705385e-09 -5.620694016855336e-09 ] [ -1.845238990717678e-09 2.757273706231202e-09 3.001782521202138e-09 ] [ 3.231481296143386e-09 -3.599090628073235e-09 3.440888984835187e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.205646 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.436213052536104e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.3070777 0.7438043 1.4712717 ] [ 0.7704954 2.2258785 -0.3824349 ] [ 2.4881046 0.6908473 0.3531077 ] [ 2.3374408 0.4748386 2.7568891 ] [ 1.8667192 2.6164262 1.7373044 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.070777e-11 7.438043e-11 1.4712717e-10 ] [ 7.704954000000001e-11 2.2258785e-10 -3.824349000000001e-11 ] [ 2.4881046e-10 6.908473000000001e-11 3.531077e-11 ] [ 2.3374408e-10 4.748386e-11 2.7568891e-10 ] [ 1.8667192e-10 2.6164262e-10 1.7373044e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.9e-06 -1.6e-06 -3.1e-06 ] [ 1.5e-06 -1.8e-06 9.8e-06 ] [ -4.5e-06 4.5e-06 2.6e-06 ] [ -7.1e-06 6.7e-06 -3.7e-06 ] [ 3.3e-06 -7.8e-06 -5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.105501868352e-14 -2.56348259328e-15 -4.96674752448e-15 ] [ 2.4032649312e-15 -2.88391791744e-15 1.570133088384e-14 ] [ -7.2097947936e-15 7.2097947936e-15 4.16565921408e-15 ] [ -1.137545400768e-14 1.073458335936e-14 -5.928053496960001e-15 ] [ 5.28718284864e-15 -1.249697764224e-14 -8.972189076479999e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.096417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.899365623764767e-18 } }