{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9865114 1.002248 2.003773 ] [ 2.302262 0.4465448 0.4828732 ] [ 2.913212 0.9916658 2.458282 ] [ 2.765138 2.782808 0.4747325 ] [ 1.558206 2.989621 2.793764 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.865114e-11 1.002248e-10 2.003773e-10 ] [ 2.302262e-10 4.465448e-11 4.828732e-11 ] [ 2.913212e-10 9.916658000000001e-11 2.458282e-10 ] [ 2.765138e-10 2.782808e-10 4.747325e-11 ] [ 1.558206e-10 2.989621e-10 2.793764e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -13.2049882 1.429844 1.9469634 ] [ 3.1802553 0.6651589 -8.8484184 ] [ 13.1079189 -2.3217563 6.0347094 ] [ -0.65865 -3.6693861 -0.2218201 ] [ -2.424536 3.8961395 1.0885657 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.115672337197988e-08 2.290862628191155e-09 3.119379241033279e-09 ] [ 5.09533068983529e-09 1.065702038697045e-09 -1.417672909153654e-08 ] [ 2.100120120892245e-08 -3.719863663055112e-09 9.668670314001995e-09 ] [ -1.05527363128992e-09 -5.879004622108491e-09 -3.553949782435181e-10 ] [ -3.884534895487948e-09 6.242303618275401e-09 1.744074514744787e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.8315298 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.5366108466585e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.0801461 1.4959641 3.5181675 ] [ 3.2950142 0.8957607 0.0281903 ] [ 2.284525 0.5297443 1.9502996 ] [ 3.8812592 2.1151045 -1.7090551 ] [ -0.015615 3.176314 4.4258224 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0801461e-10 1.4959641e-10 3.5181675e-10 ] [ 3.2950142e-10 8.957607e-11 2.81903e-12 ] [ 2.284525e-10 5.297443e-11 1.9502996e-10 ] [ 3.8812592e-10 2.1151045e-10 -1.7090551e-10 ] [ -1.5615e-12 3.176314e-10 4.4258224e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.1874763 0.1900311 0.2033406 ] [ 0.0159942 0.068291 -0.0829427 ] [ 0.112713 0.0988067 -0.2341682 ] [ -0.0388847 -0.1642527 0.1667376 ] [ 0.0976538 -0.1928761 -0.0529674 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.003701448140871e-10 3.044633856449069e-10 3.257875553794445e-10 ] [ 2.562553330839936e-11 1.094142436110528e-10 -1.328888548060281e-10 ] [ 1.805861334602304e-10 1.583057847183994e-10 -3.751788153748185e-10 ] [ -6.230015724682176e-11 -2.631618358432762e-10 2.671430845283021e-10 ] [ 1.564586352922791e-10 -3.090215781310829e-10 -8.486312994456192e-11 ] ] } "relaxed-potential-energy" { "source-value" -11.112007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.780339782556595e-18 } }