{ "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" [ 5.51626 0 0 ] "si-unit" "m" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0156708 5.55287 0 ] "si-unit" "m" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0707378 -0.0779479 5.31818 ] "si-unit" "m" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0442334 -0.0178769 0.0866315 ] [ 1.37385 1.41168 1.32363 ] [ 0.027051 2.64271 2.7677 ] [ 1.3087 3.96384 4.18589 ] [ 2.72942 0.00808237 2.56914 ] [ 4.1019 1.31789 4.05807 ] [ 2.73169 2.7615 0.0742825 ] [ 4.00667 4.08894 1.33622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.42334e-12 -1.78769e-12 8.66315e-12 ] [ 1.37385e-10 1.41168e-10 1.32363e-10 ] [ 2.7051e-12 2.64271e-10 2.7677e-10 ] [ 1.3087e-10 3.96384e-10 4.18589e-10 ] [ 2.72942e-10 8.082370000000001e-13 2.56914e-10 ] [ 4.1019e-10 1.31789e-10 4.05807e-10 ] [ 2.73169e-10 2.7615e-10 7.42825e-12 ] [ 4.00667e-10 4.08894e-10 1.33622e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.8279758 0.1447277 0.1051911 ] [ 0.0274451 -0.6063308 0.7633574 ] [ -1.6116702 0.9516113 -0.6702026 ] [ 2.2041361 1.6646655 -2.8275648 ] [ -1.1314307 -1.2902112 2.8380202 ] [ 1.0893784 -1.1636587 -0.4679043 ] [ -0.9007804 -0.5037667 -0.8559078 ] [ 3.1508975 0.8029628 1.1150107 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.530916748277457e-09 2.318793392325617e-10 1.685347225247574e-10 ] [ 4.39718979377934e-11 -9.71449040234527e-10 1.223033389670991e-09 ] [ -2.582180336154107e-09 1.524649389510364e-09 -1.073782945766048e-09 ] [ 3.531415357575887e-09 2.667088167525927e-09 -4.530258253680883e-09 ] [ -1.812751830530263e-09 -2.0671462375651e-09 4.547009651260007e-09 ] [ 1.745376618064305e-09 -1.864386779090816e-09 -7.496653364081262e-10 ] [ -1.443209309245174e-09 -8.071232357272877e-10 -1.371315478018345e-09 ] [ 5.048294350629014e-09 1.286488236131215e-09 1.786444090199984e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.775841 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.731921651189919e-18 } }