Aleksei Ivanov
aleksei-quantum.bsky.social
Aleksei Ivanov
@aleksei-quantum.bsky.social
Scientist working in the field of computational quantum chemistry and physics. More recently, I’ve started exploring quantum computation for electronic structure calculations.
Landmannalaugar and Thorsmork, Iceland.

Kamchatka, Kluchevskaya Sopka, Russia
December 8, 2024 at 8:53 PM
the accuracy problem you described can be attributed to any known classical algorithm because of its heuristic nature. We cannot say in advance what error is before we run calculations. This is why I find some quantum algorithms such as QPE fascinating, we can put the error bar in advance.
November 29, 2024 at 9:19 AM
An initio method is one which depends on the fundamental constants only such as charge of an electron, etc. The more non-fundamental constants (parameters) one introduces in a model the less it becomes ab initio and more empirical. This is why PBE is more empirical than any CC method.
November 29, 2024 at 9:19 AM
Would love to join, thanks. Here is the link to my Google scholar profile:

scholar.google.com/citations?hl...
Aleksei V. Ivanov
‪Riverlane Ltd., Cambridge, UK‬ - ‪‪Cited by 399‬‬ - ‪condensed matter physics‬ - ‪quantum chemistry‬ - ‪quantum computing‬ - ‪materials science‬
scholar.google.com
November 10, 2024 at 4:36 PM