{ "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" [ 5.37928 0 0 ] "si-unit" "m" "si-value" [ 5.37928e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.109609 5.36452 0 ] "si-unit" "m" "si-value" [ -1.09609e-11 5.36452e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.116688 0.583163 5.41925 ] "si-unit" "m" "si-value" [ -1.16688e-11 5.83163e-11 5.41925e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.149607 0.163517 0.168021 ] [ 1.37749 1.37328 1.35818 ] [ 0.000964456 2.92001 2.60942 ] [ 1.4682 4.32928 3.69686 ] [ 2.55926 -0.0770152 2.34173 ] [ 4.30694 1.43375 4.42217 ] [ 2.84059 2.75554 0.271651 ] [ 3.86093 4.12935 1.26521 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.49607e-11 1.63517e-11 1.68021e-11 ] [ 1.37749e-10 1.37328e-10 1.35818e-10 ] [ 9.64456e-14 2.92001e-10 2.60942e-10 ] [ 1.4682e-10 4.32928e-10 3.69686e-10 ] [ 2.55926e-10 -7.70152e-12 2.34173e-10 ] [ 4.30694e-10 1.43375e-10 4.422170000000001e-10 ] [ 2.84059e-10 2.75554e-10 2.71651e-11 ] [ 3.86093e-10 4.12935e-10 1.26521e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 18.005277699999997 -16.346593999999996 31.714670799999997 ] [ -1.2422629999999997 3.5106952999999996 -1.0196978999999997 ] [ -2.3408568999999995 -2.4698226999999995 1.5844650999999998 ] [ -2.8374927999999997 -8.207794899999998 8.498696399999998 ] [ 3.5138071999999996 5.465990199999999 -3.7815817999999997 ] [ -16.642144899999998 24.070047699999996 -33.94236959999999 ] [ -4.380001199999999 -7.378644799999999 -8.765695699999998 ] [ 5.923673999999999 1.3561230999999998 5.711512599999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.884763498195159e-08 -2.619013073650955e-08 5.081250409212843e-08 ] [ -1.99032473548487e-09 5.624753932412442e-09 -1.633736135658856e-09 ] [ -3.750466197818363e-09 -3.957092187461131e-09 2.538592939693534e-09 ] [ -4.54616462584833e-09 -1.315033709710147e-08 1.361641267935712e-08 ] [ 5.629739745838709e-09 8.757481707961914e-09 -6.058761949602781e-09 ] [ -2.666365547874595e-08 3.85644676864808e-08 -5.438167102767263e-08 ] [ -7.017535521715943e-09 -1.182189219174749e-08 -1.404419271558709e-08 ] [ 9.490771992040817e-09 2.17274872574682e-09 9.150851957124621e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.925549 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.551554228120482e-18 } }