[ { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/binding-energy-crystal" "instance-id" 1 "prototype-label" { "source-value" "A2B_mC168_12_e7i10j_7j" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 30.7384 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.07384e-09 } "binding-potential-energy-per-atom" { "source-value" -13.688297964152087 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.193107115739424e-18 } "binding-potential-energy-per-formula" { "source-value" -41.06489389245626 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.579321347218273e-18 } "parameter-names" { "source-value" [ "b/a" "c/a" "beta" "x2" "z2" "x3" "z3" "x4" "z4" "x5" "z5" "x6" "z6" "x7" "z7" "x8" "z8" "x9" "y9" "z9" "x10" "y10" "z10" "x11" "y11" "z11" "x12" "y12" "z12" "x13" "y13" "z13" "x14" "y14" "z14" "x15" "y15" "z15" "x16" "y16" "z16" "x17" "y17" "z17" "x18" "y18" "z18" "x19" "y19" "z19" "x20" "y20" "z20" "x21" "y21" "z21" "x22" "y22" "z22" "x23" "y23" "z23" "x24" "y24" "z24" "x25" "y25" "z25" ] } "parameter-values" { "source-value" [ 0.27732088 0.96893462 156.1875 0.91705736 0.59542979 0.22212876 0.35826546 0.57977368 0.63931722 0.19307113 0.83725974 0.42441218 0.69898329 0.84908667 0.061335987 0.85061852 0.3889006 0.47896651 0.27153014 0.53620583 0.5596153 0.27355778 0.73224054 0.40858469 0.28645674 0.65200782 0.27250413 0.25587088 0.35995265 0.66378415 0.25769717 0.75461618 0.84620859 0.72299452 0.344558 0.77108173 0.22126567 0.9335896 0.35489982 0.21142438 0.51777423 0.55548524 0.77657753 0.8515039 0.14999556 0.27425112 0.31886077 0.35872861 0.31269992 0.40414204 0.43404 0.31556113 0.6233777 0.24778388 0.18526187 0.38605658 0.59642648 0.18737499 0.64921832 0.67482696 0.31162761 0.8169527 0.43380456 0.81601077 0.72057763 0.83037029 0.18658743 0.037069374 ] } } { "property-id" "tag:staff@noreply.openkim.org,2023-02-21:property/crystal-structure-npt" "instance-id" 2 "prototype-label" { "source-value" "A2B_mC168_12_e7i10j_7j" } "stoichiometric-species" { "source-value" [ "O" "Si" ] } "a" { "source-value" 30.7384 "source-unit" "angstrom" "si-unit" "m" "si-value" 3.07384e-09 } "cell-cauchy-stress" { "source-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] "source-unit" "eV/angstrom^3" "si-unit" "kg / m s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 ] } "temperature" { "source-value" 0.0 "source-unit" "K" "si-unit" "K" "si-value" 0.0 } "parameter-names" { "source-value" [ "b/a" "c/a" "beta" "x2" "z2" "x3" "z3" "x4" "z4" "x5" "z5" "x6" "z6" "x7" "z7" "x8" "z8" "x9" "y9" "z9" "x10" "y10" "z10" "x11" "y11" "z11" "x12" "y12" "z12" "x13" "y13" "z13" "x14" "y14" "z14" "x15" "y15" "z15" "x16" "y16" "z16" "x17" "y17" "z17" "x18" "y18" "z18" "x19" "y19" "z19" "x20" "y20" "z20" "x21" "y21" "z21" "x22" "y22" "z22" "x23" "y23" "z23" "x24" "y24" "z24" "x25" "y25" "z25" ] } "parameter-values" { "source-value" [ 0.27732088 0.96893462 156.1875 0.91705736 0.59542979 0.22212876 0.35826546 0.57977368 0.63931722 0.19307113 0.83725974 0.42441218 0.69898329 0.84908667 0.061335987 0.85061852 0.3889006 0.47896651 0.27153014 0.53620583 0.5596153 0.27355778 0.73224054 0.40858469 0.28645674 0.65200782 0.27250413 0.25587088 0.35995265 0.66378415 0.25769717 0.75461618 0.84620859 0.72299452 0.344558 0.77108173 0.22126567 0.9335896 0.35489982 0.21142438 0.51777423 0.55548524 0.77657753 0.8515039 0.14999556 0.27425112 0.31886077 0.35872861 0.31269992 0.40414204 0.43404 0.31556113 0.6233777 0.24778388 0.18526187 0.38605658 0.59642648 0.18737499 0.64921832 0.67482696 0.31162761 0.8169527 0.43380456 0.81601077 0.72057763 0.83037029 0.18658743 0.037069374 ] } } ]