{ "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" [ "Mo" ] } "a" { "source-value" [ 3.79941 3.544835 3.38706 3.272428 3.182341 3.10812 3.045004 2.990098 2.941511 2.897936 2.858436 2.822313 2.789036 2.758187 2.729438 2.70252 2.677213 2.653336 2.630736 2.609283 2.588867 2.569391 2.550773 2.53294 2.514912 2.496334 2.477172 2.457387 2.436937 2.415777 2.393856 2.371115 2.347493 2.322917 2.297308 2.270575 2.242614 2.213307 2.182518 2.15009 2.115838 2.079543 2.040949 1.999742 1.955543 1.907884 1.856176 1.799668 1.737376 1.667979 1.589646 1.499729 1.394199 1.26647 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.79941e-10 3.5448350000000003e-10 3.3870600000000003e-10 3.272428e-10 3.182341e-10 3.10812e-10 3.045004e-10 2.990098e-10 2.9415110000000005e-10 2.897936e-10 2.8584360000000003e-10 2.822313e-10 2.789036e-10 2.758187e-10 2.729438e-10 2.70252e-10 2.6772130000000003e-10 2.653336e-10 2.630736e-10 2.609283e-10 2.588867e-10 2.569391e-10 2.5507730000000003e-10 2.53294e-10 2.514912e-10 2.496334e-10 2.477172e-10 2.457387e-10 2.436937e-10 2.415777e-10 2.3938560000000003e-10 2.3711150000000003e-10 2.3474930000000003e-10 2.322917e-10 2.2973080000000001e-10 2.2705750000000002e-10 2.2426140000000002e-10 2.213307e-10 2.182518e-10 2.15009e-10 2.1158380000000003e-10 2.0795430000000002e-10 2.040949e-10 1.999742e-10 1.9555430000000001e-10 1.907884e-10 1.856176e-10 1.7996680000000001e-10 1.737376e-10 1.667979e-10 1.589646e-10 1.4997290000000002e-10 1.394199e-10 1.26647e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 1.30829 2.14979 2.63738 2.9475 3.17827 3.39276 3.61521 3.85047 4.09144 4.32812 4.55227 4.75876 4.94515 5.11094 5.25674 5.38374 5.49328 5.5867 5.66477 5.72782 5.77622 5.81035 5.83057 5.83724 5.82995 5.80609 5.76226 5.69437 5.59751 5.46582 5.29228 5.0685 4.7845 4.42837 3.98589 3.43419 2.74608 1.8924 0.837206 -0.46466 -2.07127 -4.05899 -6.54739 -9.87 -14.4072 -20.7121 -29.7353 -43.7163 -66.1248 -102.485 -162.473 -272.307 -524.227 -1263.06 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.0961116684958598e-19 3.4443433060068597e-19 4.2255486109789194e-19 4.722415628715e-19 5.092149930543179e-19 5.435800796769839e-19 5.792204989003139e-19 6.169133063917979e-19 6.55520956741296e-19 6.93441273314808e-19 7.29354062565918e-19 7.624374078813839e-19 7.9230037816251e-19 8.18862864577596e-19 8.422225999013159e-19 8.62570243153116e-19 8.80120486001952e-19 8.9508802011678e-19 9.075962130984179e-19 9.17697936775788e-19 9.25452471684348e-19 9.3092070053619e-19 9.34160301690138e-19 9.35228953505016e-19 9.3406096673883e-19 9.30238173290106e-19 9.23215833103284e-19 9.123386559350579e-19 8.968199730581338e-19 8.75720908964988e-19 8.479167356585519e-19 8.120632269429e-19 7.665614105373e-19 7.095030940706579e-19 6.386099823694259e-19 5.50217897471646e-19 4.39970521109472e-19 3.0319590621815998e-19 1.341351891044604e-19 -7.4446739475444e-20 -3.31854039670518e-19 -6.503218935639659e-19 -1.049007527168526e-18 -1.5813483377579998e-18 -2.30828792013648e-18 -3.31844426610714e-18 -4.764120286498019e-18 -7.00412343849342e-18 -1.0594360948792318e-17 -1.6419907233549e-17 -2.60310444255882e-17 -4.36283912674638e-17 -8.399042503119179e-17 -2.0236452193400398e-16 ] } }