Ab initio solution of the many-electron Schrödinger equation with deep neural networks
Given access to accurate solutions of the many-electron Schrödinger equation, nearly all chemistry could be derived from first principles. Exact wave functions of interesting chemical systems are out of reach because they are NP-hard to compute in general, but approximations can be found using polyn...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
American Physical Society
2020-09-01
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| Series: | Physical Review Research |
| Online Access: | http://doi.org/10.1103/PhysRevResearch.2.033429 |