{ "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" [ [ 1.971858 1.613185 3.540739 ] [ 1.980532 3.696797 1.101352 ] [ 1.421419 3.841396 3.166588 ] [ 2.933735 5.314328 3.389927 ] [ 3.610376 2.128489 1.767833 ] [ 4.452161 4.502678 1.60274 ] [ 4.038762 3.260824 3.402783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.971858e-10 1.613185e-10 3.540739e-10 ] [ 1.980532e-10 3.696797e-10 1.101352e-10 ] [ 1.421419e-10 3.841396e-10 3.166588e-10 ] [ 2.933735e-10 5.314328e-10 3.389927e-10 ] [ 3.610376e-10 2.128489e-10 1.767833e-10 ] [ 4.452161e-10 4.502678000000001e-10 1.60274e-10 ] [ 4.038762e-10 3.260824e-10 3.402783e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.0208705 8.0389636 -1.3483233 ] [ 2.6386044 -2.9291994 -1.8357597 ] [ -0.4810093 -9.7314963 2.9651711 ] [ 1.3825026 3.1678478 1.4494121 ] [ -3.863128 -1.1403331 -4.7766588 ] [ 0.5156882 0.4419332 -0.2824713 ] [ 1.8282126 2.1522841 3.8286299 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.237791468764407e-09 1.28798395353822e-08 -2.160252068539904e-09 ] [ 4.227510281220012e-09 -4.693094796341387e-09 -2.941211272746822e-09 ] [ -7.706618548473735e-10 -1.55915758572617e-08 4.750727813091819e-09 ] [ 2.215013343915214e-09 5.075451683412714e-09 2.322214180524632e-09 ] [ -6.189413364757863e-09 -1.827015032744389e-09 -7.653051054898583e-09 ] [ 8.262235776624346e-10 7.080550409953306e-10 -4.52568912906983e-10 ] [ 2.929119485571983e-09 3.448339266339569e-09 6.134141315475842e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5841815 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.535555152880388e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2546246 1.9043236 4.3069851 ] [ 1.4620057 2.8811336 0.8906076 ] [ 1.4970263 3.6435318 2.9730113 ] [ 2.4155247 5.5226971 3.6678228 ] [ 3.4404041 1.953655 1.2835929 ] [ 5.4154801 5.2990395 2.4576507 ] [ 4.9237776 3.1533164 2.3922916 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2546246e-10 1.9043236e-10 4.306985100000001e-10 ] [ 1.4620057e-10 2.8811336e-10 8.906076000000001e-11 ] [ 1.4970263e-10 3.6435318e-10 2.9730113e-10 ] [ 2.415524700000001e-10 5.5226971e-10 3.6678228e-10 ] [ 3.4404041e-10 1.953655e-10 1.2835929e-10 ] [ 5.4154801e-10 5.2990395e-10 2.4576507e-10 ] [ 4.923777600000001e-10 3.1533164e-10 2.3922916e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1418235 -0.0313903 0.2500396 ] [ 0.8200361 -0.5558674 0.0340291 ] [ -0.1529827 0.1147116 0.2058195 ] [ -0.1248627 0.0830472 -0.0477624 ] [ -0.3814324 0.6946257 -0.1544427 ] [ 0.1180253 -0.231332 0.1446977 ] [ -0.1369601 -0.0737949 -0.4323808 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.272262959800288e-10 -5.029280477989824e-11 4.006076013941836e-10 ] [ 1.313842667632011e-09 -8.90597752544882e-10 5.452062844686528e-11 ] [ -2.451053053268602e-10 1.837882436545613e-10 3.297591910047456e-10 ] [ -2.000520987499641e-10 1.330562822629018e-10 -7.652380063329792e-11 ] [ -6.111220736956339e-10 1.112913056746835e-09 -2.474444831932282e-10 ] [ 1.890973763229062e-10 -3.706347220429057e-10 2.318312720235322e-10 ] [ -2.194342702024301e-10 -1.182324635142739e-10 -6.927504090428006e-10 ] ] } "relaxed-potential-energy" { "source-value" -14.342409 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.297907238575151e-18 } }