{ "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" [ [ 0.3152142 1.9246463 -0.322514 ] [ -1.012901 0.7592331 -0.3352809 ] [ 1.5733164 1.694655 -1.5011095 ] [ -0.5713131 0.7126168 -2.6920184 ] [ 0.3245796 -1.0353432 1.5951347 ] [ -1.4948641 -1.4197938 2.1041585 ] [ 2.5976185 -1.2418653 1.137897 ] [ -1.7316505 -1.394149 0.0137325 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.050288217841753e-10 3.083623305169223e-09 -5.167243906806912e-10 ] [ -1.622846301384941e-09 1.216425522557508e-09 -5.371792193807827e-10 ] [ 2.520730753201221e-09 2.715136621321824e-09 -2.405042546160778e-09 ] [ -9.153444919767725e-10 1.14173797654931e-09 -4.313088943243422e-09 ] [ 5.200338467086158e-10 -1.658802669544259e-09 2.555687523366822e-09 ] [ -2.395036312293233e-09 -2.274760432716791e-09 3.371233555157597e-09 ] [ 4.161843630457564e-09 -1.989687549842778e-09 1.823111970278458e-09 ] [ -2.77440994649663e-09 -2.233672933711699e-09 2.2001890445136e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -27.060933 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.33563941896352e-18 } }