{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.44972e-10 0.0 0.0 ] "source-value" [ 5.44972 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.09808e-12 5.45304e-10 0.0 ] "source-value" [ -0.0609808 5.45304 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.742489999999999e-12 -1.45247e-11 5.63878e-10 ] "source-value" [ -0.0674249 -0.145247 5.63878 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.273504506632467e-10 1.001903365656789e-09 4.664029229610468e-09 ] [ 7.003651539773079e-09 -4.419913748999938e-09 -7.523604476562343e-09 ] [ -7.329316849076356e-09 2.838229928485943e-09 8.936146351000822e-09 ] [ -1.240788636819315e-08 -1.683041502965589e-08 1.433974912074398e-08 ] [ 1.329903142427169e-08 9.822514677702115e-09 -1.815157211421484e-08 ] [ 3.067605704620437e-09 5.667163547565018e-09 3.661860543505275e-09 ] [ -1.169923724010682e-08 -1.120126488481364e-08 -1.265946110249713e-08 ] [ 8.193502079156702e-09 1.312178230427727e-08 6.732852448413773e-09 ] ] "source-value" [ [ -0.07948590000000001 0.6253389000000001 2.9110581000000004 ] [ 4.371335500000001 -2.7586932000000006 -4.695864600000001 ] [ -4.5745998000000005 1.7714838000000004 5.577503900000001 ] [ -7.744393600000002 -10.504718900000002 8.950167500000001 ] [ 8.300602600000001 6.130731500000001 -11.329320300000001 ] [ 1.9146489000000004 3.5371653000000007 2.2855536000000005 ] [ -7.302089600000002 -6.9912797000000015 -7.901414200000001 ] [ 5.113981800000001 8.189972400000002 4.202316000000001 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -8.971150000000001e-13 -3.89651e-13 -3.78043e-12 ] [ 1.32076e-10 1.2724e-10 1.76049e-10 ] [ 2.46678e-11 2.71711e-10 2.69984e-10 ] [ 1.36622e-10 4.37217e-10 4.08545e-10 ] [ 2.70002e-10 -7.780660000000001e-12 3.30264e-10 ] [ 4.02111e-10 1.29847e-10 4.36135e-10 ] [ 2.82584e-10 3.00896e-10 4.36415e-11 ] [ 4.076120000000001e-10 3.84466e-10 1.60166e-10 ] ] "source-value" [ [ -0.00897115 -0.00389651 -0.0378043 ] [ 1.32076 1.2724 1.76049 ] [ 0.246678 2.71711 2.69984 ] [ 1.36622 4.37217 4.08545 ] [ 2.70002 -0.0778066 3.30264 ] [ 4.02111 1.29847 4.36135 ] [ 2.82584 3.00896 0.436415 ] [ 4.07612 3.84466 1.60166 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.189212972800043e-18 "source-value" -26.147011 } }