{ "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" [ [ 0.6257939 0.5755022 -0.516607 ] [ 0.7824398 -0.5345779 0.3217764 ] [ -2.3174158 1.3826242 0.9727368 ] [ -1.1411476 -1.5754835 -2.2677731 ] [ 1.4899078 -1.3544437 2.3864918 ] [ 0.029179 0.918641 -0.5606479 ] [ 0.5312429 0.5877377 -0.335977 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.002632356019253e-09 9.220561700589657e-10 -8.276956575416257e-10 ] [ 1.253606754743428e-09 -8.564882133763605e-10 5.155426252051892e-10 ] [ -3.712909415432529e-09 2.215208168592303e-09 1.558496159151805e-09 ] [ -1.82832000560203e-09 -2.524202830156157e-09 -3.633373042099141e-09 ] [ 2.387095444307562e-09 -2.170058030329849e-09 3.82358136769091e-09 ] [ 4.67499116183232e-11 1.471825133108333e-09 -8.982569578806163e-10 ] [ 8.511449543459922e-10 9.416596021027642e-10 -5.382944945265217e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -18.663818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.990273285446621e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4094974 1.8035025 2.2774954 ] [ 1.8631548 4.0225443 1.5628461 ] [ 2.196857 3.4372498 3.903796 ] [ 3.6715215 1.2423738 1.9640327 ] [ 4.0486094 1.8816491 4.1954027 ] [ 4.1243598 3.4574353 1.2506442 ] [ 4.502238 4.1006872 3.480735 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4094974e-10 1.8035025e-10 2.2774954e-10 ] [ 1.8631548e-10 4.0225443e-10 1.5628461e-10 ] [ 2.196857e-10 3.4372498e-10 3.903796e-10 ] [ 3.6715215e-10 1.2423738e-10 1.9640327e-10 ] [ 4.0486094e-10 1.8816491e-10 4.1954027e-10 ] [ 4.1243598e-10 3.4574353e-10 1.2506442e-10 ] [ 4.502238e-10 4.1006872e-10 3.480735e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.3e-06 3.03e-05 -6.4e-06 ] [ -3.09e-05 -7.31e-05 6.01e-05 ] [ -3.79e-05 3.64e-05 -6.68e-05 ] [ -2.6e-06 8.8e-06 2e-07 ] [ 5.6e-06 -4.7e-06 -1.53e-05 ] [ 1.17e-05 7.1e-06 1.8e-06 ] [ 5.08e-05 -4.8e-06 2.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.28718284864e-15 4.854595161024e-14 -1.025393037312e-14 ] [ -4.950725758272e-14 -1.1711911098048e-13 9.629081491008e-14 ] [ -6.072249392832e-14 5.831922899712e-14 -1.0702539826944e-13 ] [ -4.16565921408e-15 1.409915426304e-14 3.2043532416e-16 ] [ 8.972189076479999e-15 -7.53023011776e-15 -2.451330229824e-14 ] [ 1.874546646336e-14 1.137545400768e-14 2.88391791744e-15 ] [ 8.139057233664001e-14 -7.69044777984e-15 4.213724512704e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.906032 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.669950894569667e-18 } }