{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Mn" ] } "a" { "source-value" [ 3.96974 3.703752 3.538903 3.419132 3.325006 3.247457 3.181511 3.124144 3.073378 3.02785 2.986579 2.948837 2.914067 2.881836 2.851798 2.823672 2.797231 2.772284 2.748671 2.726256 2.704924 2.684575 2.665122 2.64649 2.627654 2.608243 2.588222 2.56755 2.546184 2.524075 2.501171 2.477411 2.45273 2.427053 2.400296 2.372364 2.34315 2.312529 2.280361 2.246479 2.210691 2.17277 2.132445 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.96974e-10 3.7037520000000004e-10 3.538903e-10 3.419132e-10 3.325006e-10 3.247457e-10 3.181511e-10 3.124144e-10 3.073378e-10 3.02785e-10 2.986579e-10 2.948837e-10 2.914067e-10 2.881836e-10 2.8517980000000003e-10 2.823672e-10 2.797231e-10 2.772284e-10 2.748671e-10 2.726256e-10 2.704924e-10 2.684575e-10 2.665122e-10 2.64649e-10 2.6276540000000005e-10 2.608243e-10 2.588222e-10 2.56755e-10 2.546184e-10 2.524075e-10 2.5011709999999997e-10 2.477411e-10 2.45273e-10 2.427053e-10 2.400296e-10 2.3723640000000004e-10 2.3431500000000003e-10 2.3125290000000002e-10 2.2803610000000002e-10 2.246479e-10 2.2106910000000002e-10 2.17277e-10 2.1324450000000002e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.530414 0.795989 1.02884 1.24186 1.43974 1.62572 1.80067 1.96521 2.12036 2.26582 2.40175 2.52878 2.64636 2.75443 2.85295 2.94187 3.02094 3.08998 3.14883 3.19763 3.23584 3.26326 3.27964 3.28481 3.27837 3.25683 3.21623 3.1515 3.05623 2.92213 2.73854 2.49151 2.16285 1.72813 1.1548 0.399408 -0.599772 -1.92719 -3.70359 -6.10287 -9.38169 -13.9263 -20.3346 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 8.49816917146476e-20 1.2753149767210257e-19 1.64838340812456e-19 1.9896790746992397e-19 2.30671778703516e-19 2.60469059742648e-19 2.8849913995447796e-19 3.1486135429031395e-19 3.3971912476682397e-19 3.63024386084988e-19 3.8480277307094993e-19 4.0515522285265196e-19 4.23993615715224e-19 4.41308338598862e-19 4.570929827970299e-19 4.71339537426558e-19 4.840079480715959e-19 4.95069375552732e-19 5.04498185043822e-19 5.12316807017742e-19 5.184387239362559e-19 5.228318922666839e-19 5.25456257593176e-19 5.262845829129539e-19 5.252527811606579e-19 5.21801692691022e-19 5.152968555569819e-19 5.049259662050999e-19 4.896620294129819e-19 4.68176840751042e-19 4.387624799274359e-19 3.9918391053773397e-19 3.4652677328469e-19 2.76876950651442e-19 1.8501935769431999e-19 6.39922165032672e-20 -9.609406841274479e-20 -3.0876987872784595e-19 -5.93380535991606e-19 -9.77787571433958e-19 -1.5031124505431461e-18 -2.23123924580742e-18 -3.2579620981736395e-18 ] } }