{ "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" [ [ 1.232696 1.429874 2.018017 ] [ 2.664166 0.3933008 4.008788 ] [ 2.480457 2.487888 4.841749 ] [ 1.659099 3.474448 2.765735 ] [ 4.127261 1.03872 2.31822 ] [ 4.538799 1.714568 4.545045 ] [ 3.952007 3.51716 3.378238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.232696e-10 1.429874e-10 2.018017e-10 ] [ 2.664166e-10 3.933008e-11 4.008788e-10 ] [ 2.480457e-10 2.487888e-10 4.841749e-10 ] [ 1.659099e-10 3.474448e-10 2.765735e-10 ] [ 4.127261e-10 1.03872e-10 2.31822e-10 ] [ 4.538799e-10 1.714568e-10 4.545045e-10 ] [ 3.952007e-10 3.51716e-10 3.378238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1379706 -5.2928135 -1.387995 ] [ -8.1052864 -7.6209065 -0.5419654 ] [ -11.3967128 2.5903938 9.1125889 ] [ -2.2142274 5.2835753 0.3044961 ] [ 3.872748 -2.476655 -6.8263411 ] [ 13.154508 -2.7902242 5.4354848 ] [ 5.8269413 10.3066302 -6.0962683 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.82322990549896e-09 -8.48002211781976e-09 -2.22381315710883e-09 ] [ -1.298610048195798e-08 -1.221003832419872e-08 -8.683243003164636e-10 ] [ -1.825954695256871e-08 4.150268419218469e-09 1.459997701082776e-08 ] [ -3.547583402642571e-09 8.465220889639539e-09 4.878565365641273e-10 ] [ 6.204826354970231e-09 -3.968038771479269e-09 -1.093700420613386e-08 ] [ 2.107584534936607e-08 -4.470432016861342e-09 8.708606741022162e-09 ] [ 9.335789198549584e-09 1.651304208171874e-08 -9.767298624854901e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.2328082 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.47925895642436e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0513641 1.687931 1.8200487 ] [ 2.1374888 0.1620545 3.5064275 ] [ 2.4133953 2.0019041 5.0790556 ] [ 1.6764504 3.5740764 3.370394 ] [ 4.5969129 0.1849525 2.9563842 ] [ 4.719182 2.2842337 4.3455931 ] [ 4.0596915 4.1608066 2.797889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0513641e-10 1.687931e-10 1.8200487e-10 ] [ 2.1374888e-10 1.620545e-11 3.5064275e-10 ] [ 2.4133953e-10 2.0019041e-10 5.0790556e-10 ] [ 1.6764504e-10 3.5740764e-10 3.370394e-10 ] [ 4.596912900000001e-10 1.849525e-11 2.9563842e-10 ] [ 4.719182e-10 2.2842337e-10 4.3455931e-10 ] [ 4.0596915e-10 4.1608066e-10 2.797889e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.2e-06 2.1e-06 1.9e-06 ] [ 2.7e-06 -3.5e-06 -9.9e-06 ] [ -3.9e-06 1.58e-05 -8.8e-06 ] [ -1.06e-05 8.4e-06 1.27e-05 ] [ 1.2e-06 -1.28e-05 -1e-07 ] [ 1.29e-05 6.8e-06 1.2e-06 ] [ -1.15e-05 -1.68e-05 3.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.47400250328e-14 3.364570931399999e-15 3.0441356046e-15 ] [ 4.3258769118e-15 -5.607618218999999e-15 -1.58615486766e-14 ] [ -6.248488872599999e-15 2.53143908172e-14 -1.40991543792e-14 ] [ -1.69830723204e-14 1.34582837256e-14 2.03476432518e-14 ] [ 1.9226119608e-15 -2.05078609152e-14 -1.602176634e-16 ] [ 2.06680785786e-14 1.08948011112e-14 1.9226119608e-15 ] [ -1.8425031291e-14 -2.691656745119999e-14 4.9667475654e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.894908 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.347733336717967e-18 } }