{ "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" [ [ 1.60665 2.271209 0.858315 ] [ 1.14021 1.706761 3.269891 ] [ 0.6855745 3.746661 2.498398 ] [ 2.590166 5.193842 1.980174 ] [ 3.090456 3.322533 2.927067 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.60665e-10 2.271209e-10 8.58315e-11 ] [ 1.14021e-10 1.706761e-10 3.269891e-10 ] [ 6.855745e-11 3.746661e-10 2.498398e-10 ] [ 2.590166e-10 5.193842e-10 1.980174e-10 ] [ 3.090456e-10 3.322533e-10 2.927067e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1611626 -7.9869371 -17.0223821 ] [ -4.3910057 -11.9634385 9.7147826 ] [ -18.5805293 9.9919855 0.561012 ] [ 3.0457754 10.0311538 -2.0291419 ] [ 21.0869221 -0.0727636 8.7757294 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.860387570667342e-09 -1.279648389342015e-08 -2.727286263094441e-08 ] [ -7.035166674339539e-09 -1.916754146907862e-08 1.556479755787464e-08 ] [ -2.976928964654939e-08 1.60089255634726e-08 8.988403103882495e-10 ] [ 4.879870138087769e-09 1.607168009800908e-08 -3.251043712465692e-09 ] [ 3.378497359325084e-08 -1.165801387652429e-10 1.406026847514721e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 4.5838464 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.344131535418245e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.5465817 2.0327885 1.3593492 ] [ 2.3249296 1.3616773 2.7447069 ] [ 0.5316652 4.3835585 1.2832906 ] [ 2.3007909 5.1653035 2.6216466 ] [ 3.4090891 3.2976783 3.5248516 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.465817e-11 2.0327885e-10 1.3593492e-10 ] [ 2.3249296e-10 1.3616773e-10 2.7447069e-10 ] [ 5.316652e-11 4.3835585e-10 1.2832906e-10 ] [ 2.3007909e-10 5.165303500000001e-10 2.6216466e-10 ] [ 3.4090891e-10 3.2976783e-10 3.5248516e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -7e-07 -9e-07 -9e-07 ] [ 2e-07 2.8e-06 4e-07 ] [ 2.4e-06 -5e-07 2.1e-06 ] [ -3e-07 -1.5e-06 -3e-07 ] [ -1.5e-06 1e-07 -1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.12152363456e-15 -1.44195895872e-15 -1.44195895872e-15 ] [ 3.2043532416e-16 4.48609453824e-15 6.408706483200001e-16 ] [ 3.84522388992e-15 -8.010883104e-16 3.36457090368e-15 ] [ -4.8065298624e-16 -2.4032649312e-15 -4.8065298624e-16 ] [ -2.4032649312e-15 1.6021766208e-16 -2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.83321 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.735671579021677e-18 } }