{ "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" [ 5.46856 0 0 ] "si-unit" "m" "si-value" [ 5.46856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.109414 5.47364 0 ] "si-unit" "m" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0853482 0.188746 5.50226 ] "si-unit" "m" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.353829 -1.2187655 -0.5855346 ] [ -0.0837844 -0.0835828 2.1635406 ] [ 1.3450894 -0.763188 -0.268643 ] [ -1.0714326 0.1574203 -0.8010033 ] [ -0.3110045 -0.3540403 -1.8375861 ] [ 0.4189129 0.8136284 0.9176606 ] [ -0.0118633 -1.2985987 -1.3348631 ] [ 1.0679114 2.7471265 1.7464289 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.169073172361043e-09 -1.952677590337622e-09 -9.381298467894797e-10 ] [ -1.342374068677555e-10 -1.339144080610022e-10 3.466374167471605e-09 ] [ 2.155070789565899e-09 -1.22276197087511e-09 -4.304135339415744e-10 ] [ -1.716624262482958e-09 2.522151242993223e-10 -1.283348760443649e-09 ] [ -4.982841388635936e-10 -5.672350914810181e-10 -2.944137488127051e-09 ] [ 6.711724545315283e-10 1.303576400498911e-09 1.470254359149301e-09 ] [ -1.900710190553664e-11 -2.080584476941273e-09 -2.138686450788613e-09 ] [ 1.710982678165797e-09 4.401381852680131e-09 2.798087553469461e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.936237 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.437184551932793e-18 } }