{ "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" [ 5.30636 0 0 ] "si-unit" "m" "si-value" [ 5.30636e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0781877 5.44815 0 ] "si-unit" "m" "si-value" [ -7.81877e-12 5.44815e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00200818 -0.0968672 5.44923 ] "si-unit" "m" "si-value" [ -2.00818e-13 -9.686720000000001e-12 5.44923e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0183636 0.00704735 0.0168371 ] [ 1.29138 1.3449 1.40641 ] [ -0.0614737 2.68753 2.83465 ] [ 1.25782 4.05715 4.11756 ] [ 2.70205 0.0250121 2.83894 ] [ 3.96698 1.43423 4.04452 ] [ 2.67871 2.79142 0.0958918 ] [ 4.00247 4.11579 1.29634 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.83636e-12 7.04735e-13 1.68371e-12 ] [ 1.29138e-10 1.3449e-10 1.40641e-10 ] [ -6.14737e-12 2.687530000000001e-10 2.83465e-10 ] [ 1.25782e-10 4.05715e-10 4.117560000000001e-10 ] [ 2.70205e-10 2.50121e-12 2.83894e-10 ] [ 3.96698e-10 1.43423e-10 4.044520000000001e-10 ] [ 2.67871e-10 2.79142e-10 9.589180000000001e-12 ] [ 4.00247e-10 4.11579e-10 1.29634e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.31893050000000006 1.2066549000000002 -0.9561650000000003 ] [ 0.4704718000000001 0.21626180000000006 0.4728136000000001 ] [ 0.8010581000000002 1.0145138000000002 -2.0150530000000004 ] [ 0.7053415000000001 -0.15920250000000002 0.6927808000000001 ] [ -0.44263570000000013 -0.5987356000000001 -1.6192612000000004 ] [ -0.18785520000000006 -1.2172851000000002 2.1524434000000006 ] [ -1.1630403000000002 -0.3806252000000001 -1.0689359000000003 ] [ -0.5022708000000001 -0.08158210000000002 2.3413773000000004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.109829907600545e-10 1.933274270153762e-09 -1.531945208627232e-09 ] [ 7.537789187056936e-10 3.464895999321255e-10 7.57530895916283e-10 ] [ 1.283436559722469e-09 1.625430291838967e-09 -3.228470806272903e-09 ] [ 1.130081660980003e-09 -2.55070523472912e-10 1.109957201099121e-09 ] [ -7.091805700714427e-10 -9.592801803606607e-10 -2.594342437608554e-09 ] [ -3.009772095357082e-10 -1.950305728068191e-09 3.448594493075263e-09 ] [ -1.863395977708219e-09 -6.098287967273243e-10 -1.712624108113807e-09 ] [ -8.047265330705128e-10 -1.307089332957677e-10 3.751299970531828e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -23.319417 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.736182472808608e-18 } }