{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.4737 0 0 ] "si-unit" "m" "si-value" [ 5.4737e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00330015 5.48579 0 ] "si-unit" "m" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0734366 -0.160082 5.49307 ] "si-unit" "m" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7207582 -0.3369596 0.2561778 ] [ -0.2150666 0.4517177 -0.4316154 ] [ -0.5076096 -0.7797477 -1.0139145 ] [ -0.1762322 1.4990255 -1.3156706 ] [ -0.2137056 -0.7811775 -0.1028449 ] [ 0.1125561 0.5179625 0.7549412 ] [ -0.033726 -1.3850461 0.710621 ] [ 0.3130257 0.8142253 1.1423056 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.154781937289891e-09 -5.398687932741197e-10 4.104420819279782e-10 ] [ -3.445746784349453e-10 7.237315381415482e-10 -6.915241030572403e-10 ] [ -8.132802336136397e-10 -1.249293535062572e-09 -1.624470107390122e-09 ] [ -2.823551106721498e-10 2.40170361008303e-09 -2.107936675993909e-09 ] [ -3.423941160540365e-10 -1.251584327194992e-09 -1.647756943485139e-10 ] [ 1.803347519484269e-10 8.298674079511199e-10 1.209549140718697e-09 ] [ -5.40350087131008e-11 -2.219088480150219e-09 1.138540352449517e-09 ] [ 5.015224582495545e-10 1.304532739723866e-09 1.830175326128917e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.956951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.921156286825118e-18 } }