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mattwthompson / scattering

Functions for analyzing molecular simulations according to scattering experiments
MIT License
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Small change to the requirements.txt and warnings #57

Closed ramanishsingh closed 2 years ago

ramanishsingh commented 3 years ago
  1. Added periodictable to the requirements
  2. Removed the warning "Estimating atomic form factor as atomic number" as now we have an option to use Cromer-Mann form factors.
ramanishsingh commented 3 years ago

Should we make 'cromer-mann' the default method?

rmatsum836 commented 2 years ago

Thanks!