(rank:0 hostname:node-as-agpu-001 pid:11185):ARMCI DASSERT fail. ../../ga-5-3/armci/src/common/armci.c:ARMCI_Error():208 cond:0
iter_orthog: failed to converge, error = 0.199219241745242
iter_orthog: failed to converge 0
iter_orthog: failed to converge, error = 0.199219241745242
iter_orthog: failed to converge, error = 0.199219241745242
iter_orthog: failed to converge 0
iter_orthog: failed to converge, error = 0.199219241745242
iter_orthog: failed to converge 0
Is the error because of a bad input file or a bad NWChem build?
Appreciate any pointers on this.
Thanks.
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