{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.457406 2.100076 2.252169 ] [ 2.703043 4.198802 1.427674 ] [ 1.54274 3.831579 3.120531 ] [ 4.586348 2.503005 1.027399 ] [ 4.020521 2.853252 3.469677 ] [ 5.359849 4.671518 1.954564 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.457406e-10 2.100076e-10 2.252169e-10 ] [ 2.703043e-10 4.198802e-10 1.427674e-10 ] [ 1.54274e-10 3.831579e-10 3.120531e-10 ] [ 4.586348e-10 2.503005e-10 1.027399e-10 ] [ 4.020521e-10 2.853252e-10 3.469677e-10 ] [ 5.359849e-10 4.671518e-10 1.954564e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2664977 -4.6968917 -2.858436 ] [ 3.3419406 1.678037 -4.5043767 ] [ -2.0747935 1.6793943 5.5323343 ] [ -0.5584957 1.3593955 1.3896066 ] [ 0.7902273 1.8370611 0.3411271 ] [ -1.7653763 -1.8569961 0.0997447 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.269763844369722e-10 -7.525250072169568e-09 -4.579719331253069e-09 ] [ 5.354379097422325e-09 2.68851165023737e-09 -7.216807040016255e-09 ] [ -3.324185638687805e-09 2.690686284564782e-09 8.863776673909933e-09 ] [ -8.948087533573307e-10 2.177991688520726e-09 2.226395206629377e-09 ] [ 1.266083705177908e-09 2.943296345401131e-09 5.465458643413038e-10 ] [ -2.828444634774407e-09 -2.975235736336779e-09 1.598086263887098e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -22.09275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.53964875391792e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3950534 2.0523621 2.0353018 ] [ 2.7952086 4.1699619 1.0003438 ] [ 2.1003518 4.0008096 3.2387133 ] [ 4.529206 2.5379598 1.2132888 ] [ 4.0908609 2.7913364 3.5497785 ] [ 4.7592263 4.6058022 2.2145877 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3950534e-10 2.0523621e-10 2.0353018e-10 ] [ 2.7952086e-10 4.1699619e-10 1.0003438e-10 ] [ 2.1003518e-10 4.0008096e-10 3.2387133e-10 ] [ 4.529206000000001e-10 2.5379598e-10 1.2132888e-10 ] [ 4.0908609e-10 2.7913364e-10 3.5497785e-10 ] [ 4.7592263e-10 4.6058022e-10 2.2145877e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.29e-05 -1.46e-05 8.3e-06 ] [ -3.09e-05 3.15e-05 -2.81e-05 ] [ -7.2e-05 -4.51e-05 -3.47e-05 ] [ -2.97e-05 1.68e-05 3.09e-05 ] [ 7.79e-05 3e-06 2.35e-05 ] [ 9.75e-05 8.3e-06 1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.873337703232e-14 -2.339177866368e-14 1.329806595264e-14 ] [ -4.950725758272e-14 5.04685635552e-14 -4.502116304448e-14 ] [ -1.153567166976e-13 -7.225816559807999e-14 -5.559552874176001e-14 ] [ -4.758464563776e-14 2.691656722944e-14 4.950725758272e-14 ] [ 1.2480955876032e-13 4.8065298624e-15 3.76511505888e-14 ] [ 1.56212220528e-13 1.329806595264e-14 1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -26.223076 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.201399929266158e-18 } }