Chemistry
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jjgoings

Theoretical chemistry post-doc at Yale

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  • New Haven, CT, United States
  • jjgoings
  • joshuagoings.com
  • Member for 7 years, 3 months
  • 252 profile views
  • Last seen Feb 4 at 23:08

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15 How to visualise the total electron density from a Gaussian 16 calculation? Apr 5 '18
12 Why is CCSD(T)/aug-cc-pVTZ not a suitable method for the geometry optimisation of omeprazole? Jan 19 '14
12 Is it true that all of the physical laws and mathematics needed to describe chemistry are known? May 8 '16
11 Why are excited Slater determinants used to describe electron correlation? Feb 25 '14
10 What is a virtual state? Nov 20 '16
10 How do Quantum Software Packages Work? Sep 29 '14
10 Coefficients and Parameters for contracted Gaussian basis sets Aug 21 '14
8 How to visualize or think about spin waves (magnons)? Apr 15 '15
7 Configuration Interaction matrix composition from electronic configurations Jan 19 '14
7 Why is no dynamical correlation recovered in the CASSCF method? May 8 '16
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