{ "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" [ 5.4207 0 0 ] "si-unit" "m" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.121917 5.37017 0 ] "si-unit" "m" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0328689 -0.300504 5.4102 ] "si-unit" "m" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.1019661999999997 5.6239612999999995 -1.3545839999999998 ] [ -0.5095209999999999 -10.406952599999999 0.38368549999999996 ] [ -4.737583599999999 10.468977499999998 -1.5509906999999998 ] [ -0.16898029999999997 -2.8681171999999995 0.44496469999999994 ] [ -1.7834857999999998 -0.37623239999999997 -3.4484477999999994 ] [ -0.6146341999999999 0.5191243999999999 4.196155399999999 ] [ 5.021203999999999 5.358662299999999 -6.4221832999999995 ] [ 0.6910346999999999 -8.319423399999998 7.751400199999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.36772113109777e-09 9.010579385380263e-09 -2.170282833590256e-09 ] [ -8.163426407323137e-10 -1.667377628686554e-08 6.147319429046068e-10 ] [ -7.5904457455416e-09 1.677315113237173e-08 -2.484961059091303e-09 ] [ -2.707362882663101e-10 -4.595230361413503e-09 7.129120452948196e-10 ] [ -2.857459275830797e-09 -6.027907602337414e-10 -5.525022488728704e-09 ] [ -9.847525536972826e-10 8.317289838192694e-10 6.722982134512922e-09 ] [ 8.044855723347334e-09 8.585523526556695e-09 -1.028947202252501e-08 ] [ 1.1071596496232e-09 -1.332918577983283e-08 1.241911228122293e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -24.167986 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.872138246003912e-18 } }