{ "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" [ [ 1.26846 0.3454837 2.901552 ] [ 0.267977 2.35609 2.023372 ] [ 2.685563 0.3914351 1.602855 ] [ 2.683655 1.904541 0.876934 ] [ 1.547568 2.030572 0.3165864 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.26846e-10 3.454837e-11 2.901552e-10 ] [ 2.67977e-11 2.35609e-10 2.023372e-10 ] [ 2.685563e-10 3.914351e-11 1.602855e-10 ] [ 2.683655e-10 1.904541e-10 8.769340000000001e-11 ] [ 1.547568e-10 2.030572e-10 3.165864e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.9537419 -0.5091459 6.6946904 ] [ -3.0240303 0.9021237 3.1347077 ] [ 8.4417986 -22.6097028 5.0556969 ] [ 95.4250979 10.2205908 36.3699414 ] [ -93.8891242 11.9961342 -51.2550364 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.114112269925737e-08 -8.157416575561749e-10 1.07260764423742e-08 ] [ -4.84503064725081e-09 1.445361501209593e-09 5.02235538998174e-09 ] [ 1.352525235442217e-08 -3.62247372293963e-08 8.100119375031035e-09 ] [ 1.528878608929312e-07 1.637519163052357e-08 5.827106981094602e-08 ] [ -1.504269597406275e-07 1.921992575521931e-08 -8.2119621018333e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 20.501023 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.284625975308308e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2004364 0.5960343 2.711915 ] [ 0.4751907 2.8934643 2.0655763 ] [ 2.90611 -0.0822085 1.0229643 ] [ 2.8751469 2.3166838 1.7057964 ] [ 0.996339 1.3041479 0.2150474 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2004364e-10 5.960343000000001e-11 2.711915e-10 ] [ 4.751907000000001e-11 2.8934643e-10 2.0655763e-10 ] [ 2.90611e-10 -8.220850000000001e-12 1.0229643e-10 ] [ 2.8751469e-10 2.3166838e-10 1.7057964e-10 ] [ 9.96339e-11 1.3041479e-10 2.150474e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.7e-06 2.46e-05 7.31e-05 ] [ -9.5e-06 -2.48e-05 -4.88e-05 ] [ 3.66e-05 -4.61e-05 -5.1e-05 ] [ -1.18e-05 -4.8e-06 2.96e-05 ] [ -1.7e-05 5.1e-05 -2.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.72370025536e-15 3.941354487168e-14 1.1711911098048e-13 ] [ -1.52206778976e-14 -3.973398019584e-14 -7.818621909504e-14 ] [ 5.863966432128e-14 -7.386034221888001e-14 -8.17110076608e-14 ] [ -1.890568412544e-14 -7.69044777984e-15 4.742442797568e-14 ] [ -2.72370025536e-14 8.17110076608e-14 -4.646312200320001e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }