{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0771463 2.5071073 -0.5268639 ] [ -1.3390417 0.9736403 -0.3155527 ] [ 1.6605832 1.7425721 -1.5822982 ] [ -0.2310114 0.9159042 -3.4331862 ] [ 0.0379878 -1.5777563 2.2028436 ] [ -1.5419837 -1.3849484 2.7451492 ] [ 3.4023708 -1.2959034 1.1567645 ] [ -2.0660514 -1.8806157 -0.2468562 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.23601998241223e-10 4.016828701897012e-09 -8.441290229235092e-10 ] [ -2.145381306016287e-09 1.559943725728698e-09 -5.055711585703163e-10 ] [ 2.660547579933251e-09 2.79190827867836e-09 -2.535121183173923e-09 ] [ -3.701210642182771e-10 1.467440296132527e-09 -5.500570664493194e-09 ] [ 6.086316503562624e-11 -2.527844257179911e-09 3.529344515198907e-09 ] [ -2.470530233794681e-09 -2.218931947494367e-09 4.398213868847823e-09 ] [ 5.451198951052592e-09 -2.076266130295231e-09 1.853341037671402e-09 ] [ -3.310179250451109e-09 -3.013078507249426e-09 -3.95507232339529e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.751673 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.72804946350866e-18 } }