{ "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" [ [ 2.290406 1.365127 2.478138 ] [ 1.892594 2.812526 4.141756 ] [ 2.634032 3.625436 1.937955 ] [ 4.696761 2.293416 2.137678 ] [ 4.185297 2.165547 4.431715 ] [ 4.453239 5.273552 2.545611 ] [ 3.870361 4.380343 4.592008 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.290406e-10 1.365127e-10 2.478138e-10 ] [ 1.892594e-10 2.812526e-10 4.141756e-10 ] [ 2.634032e-10 3.625436e-10 1.937955e-10 ] [ 4.696761000000001e-10 2.293416e-10 2.137678e-10 ] [ 4.185297000000001e-10 2.165547e-10 4.431715e-10 ] [ 4.453239e-10 5.273551999999999e-10 2.545611e-10 ] [ 3.870361e-10 4.380343e-10 4.592008e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.4104047 -1.1686093 0.2301044 ] [ 0.3862957 2.2571592 1.4011338 ] [ 1.883854 1.4911381 2.7554773 ] [ -2.0733372 2.865789 0.9469145 ] [ -1.5954203 -1.8769659 -2.1771877 ] [ -0.0137086 -3.0512987 -0.9710396 ] [ -1.9980883 -0.5172125 -2.1854027 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.464070677806438e-09 -1.872318499309453e-09 3.686678900232115e-10 ] [ 6.189139392555706e-10 3.616367699663631e-09 2.244863816972663e-09 ] [ 3.018266835800563e-09 2.389066602204132e-09 4.414761309205108e-09 ] [ -3.321852388874934e-09 4.591500135945811e-09 1.517124273796522e-09 ] [ -2.556145105009722e-09 -3.007230883018831e-09 -3.488239232033324e-09 ] [ -2.196359842389888e-11 -4.888719440217433e-09 -1.555776944990984e-09 ] [ -3.201290360554017e-09 -8.286657754855201e-10 -3.501401112973197e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.285031 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.051108552440325e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.649513 1.4622087 2.4840504 ] [ 1.8121425 2.8615131 4.2695919 ] [ 2.4986233 3.8514073 2.1783563 ] [ 4.710608 2.715825 2.4144099 ] [ 3.9537096 1.7620826 4.4981297 ] [ 4.5523928 5.1017717 2.1616588 ] [ 3.8457008 4.1611386 4.2586641 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.649513e-10 1.4622087e-10 2.4840504e-10 ] [ 1.8121425e-10 2.8615131e-10 4.2695919e-10 ] [ 2.4986233e-10 3.8514073e-10 2.1783563e-10 ] [ 4.710608e-10 2.715825e-10 2.4144099e-10 ] [ 3.9537096e-10 1.7620826e-10 4.4981297e-10 ] [ 4.5523928e-10 5.1017717e-10 2.1616588e-10 ] [ 3.8457008e-10 4.1611386e-10 4.2586641e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.5e-06 6.1e-06 5.2e-06 ] [ -6.7e-06 -6.2e-06 4.7e-06 ] [ -4.8e-06 5.5e-06 -3.3e-06 ] [ -4.4e-06 1.17e-05 1.2e-06 ] [ -2.3e-06 -6.5e-06 1.1e-05 ] [ 9.5e-06 5e-06 -9.6e-06 ] [ 1.2e-06 -1.56e-05 -9.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.2016324656e-14 9.77327738688e-15 8.33131842816e-15 ] [ -1.073458335936e-14 -9.93349504896e-15 7.53023011776e-15 ] [ -7.69044777984e-15 8.8119714144e-15 -5.28718284864e-15 ] [ -7.04957713152e-15 1.874546646336e-14 1.92261194496e-15 ] [ -3.68500622784e-15 -1.04141480352e-14 1.76239428288e-14 ] [ 1.52206778976e-14 8.010883104e-15 -1.538089555968e-14 ] [ 1.92261194496e-15 -2.499395528448e-14 -1.474002491136e-14 ] ] } "relaxed-potential-energy" { "source-value" -29.696935 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.757973496641725e-18 } }