journal article·2016-07-28Open access

Jastrow correlation factor for periodic systems

T. M. Whitehead, M. H. Michael, G. J. Conduit

Physical Review B· Volume 94· Issue 3

Abstract

We propose a Jastrow factor for electron-electron correlations that interpolates between the radial symmetry of the Coulomb interaction at short interparticle distance and the space-group symmetry of the simulation cell at large separation. The proposed Jastrow factor captures comparable levels of the correlation energy to current formalisms, is 40% quicker to evaluate, and offers benefits in ease of use, as we demonstrate in quantum Monte Carlo simulations.
Source: openalex_inverted_index · Quality: baseline

Research context

OpenAlex topics: Advanced Chemical Physics Studies · Physics of Superconductivity and Magnetism · Quantum, superfluid, helium dynamics

SciVX discovery tags are terminology-based. OpenAlex topics are source-provided classifications.

References (49)

Show source-provided references
1. 10.1103/RevModPhys.73.3310.1103/RevModPhys.73.33 ↗
2. 10.1063/1.44376610.1063/1.443766 ↗
3. 10.1103/PhysRev.98.147910.1103/PhysRev.98.1479 ↗
4. 10.1103/PhysRevB.53.964010.1103/PhysRevB.53.9640 ↗
5. 10.1103/PhysRevB.70.23511910.1103/PhysRevB.70.235119 ↗
6. 10.1103/PhysRevE.86.03670310.1103/PhysRevE.86.036703 ↗
7. 10.1103/PhysRevB.50.139110.1103/PhysRevB.50.1391 ↗
8. 10.1103/PhysRev.138.A44210.1103/PhysRev.138.A442 ↗
9. 10.1103/PhysRevB.18.312610.1103/PhysRevB.18.3126 ↗
10. 10.1103/PhysRevB.72.20532710.1103/PhysRevB.72.205327 ↗
11. 10.1103/PhysRevLett.98.06040510.1103/PhysRevLett.98.060405 ↗
12. 10.1063/1.43286810.1063/1.432868 ↗
13. 10.1088/0953-8984/22/2/02320110.1088/0953-8984/22/2/023201 ↗
14. 10.1103/PhysRevLett.60.171910.1103/PhysRevLett.60.1719 ↗
15. 10.1002/cpa.316010020110.1002/cpa.3160100201 ↗
16. 10.1063/1.489835610.1063/1.4898356 ↗
17. 10.1063/1.488607510.1063/1.4886075 ↗
18. 10.1063/1.492644410.1063/1.4926444 ↗
19. 10.1103/PhysRevB.92.07510610.1103/PhysRevB.92.075106 ↗
20. 10.1103/PhysRevLett.103.20720110.1103/PhysRevLett.103.207201 ↗
21. 10.1103/PhysRevB.87.04513110.1103/PhysRevB.87.045131 ↗
22. 10.1103/PhysRevA.93.02270610.1103/PhysRevA.93.022706 ↗
23. 10.1103/PhysRevLett.97.07640410.1103/PhysRevLett.97.076404 ↗
24. 10.1103/PhysRevB.88.08512110.1103/PhysRevB.88.085121 ↗
25. 10.1103/PhysRevB.87.18442410.1103/PhysRevB.87.184424 ↗
26. 10.1103/PhysRevB.82.18410810.1103/PhysRevB.82.184108 ↗
27. 10.1103/PhysRevLett.115.11550110.1103/PhysRevLett.115.115501 ↗
28. 10.1103/PhysRevB.72.08512410.1103/PhysRevB.72.085124 ↗
29. 10.1103/PhysRevLett.45.56610.1103/PhysRevLett.45.566 ↗
30. 10.1103/PhysRevE.66.03670310.1103/PhysRevE.66.036703 ↗
31. 10.1103/PhysRevB.69.08511610.1103/PhysRevB.69.085116 ↗
32. 10.1103/PhysRevB.59.1234410.1103/PhysRevB.59.12344 ↗
33. 10.1103/PhysRevLett.98.11020110.1103/PhysRevLett.98.110201 ↗
34. 10.1103/PhysRevE.83.06670610.1103/PhysRevE.83.066706 ↗
35. 10.1103/PhysRevB.78.12510610.1103/PhysRevB.78.125106 ↗
36. V. Heine · Solid State Phys. · 1970 · 24 · 110.1016/S0081-1947(08)60069-7 ↗
37. 10.1016/0167-7977(89)90002-610.1016/0167-7977(89)90002-6 ↗
38. 10.1103/PhysRev.136.B86410.1103/PhysRev.136.B864 ↗
39. 10.1103/PhysRev.140.A113310.1103/PhysRev.140.A1133 ↗
40. 10.1103/RevModPhys.64.104510.1103/RevModPhys.64.1045 ↗
41. 10.1524/zkri.220.5.567.6507510.1524/zkri.220.5.567.65075 ↗
42. 10.1103/PhysRevB.55.1348510.1103/PhysRevB.55.13485 ↗
43. 10.1103/PhysRevB.70.16110110.1103/PhysRevB.70.161101 ↗
44. 10.1063/1.47465810.1063/1.474658 ↗
45. 10.1103/PhysRevA.93.04270210.1103/PhysRevA.93.042702 ↗
46. 10.1103/PhysRevLett.114.10740110.1103/PhysRevLett.114.107401 ↗
47. 10.1051/jphys:0198800490405530010.1051/jphys:01988004904055300 ↗
48. 10.1103/RevModPhys.73.51510.1103/RevModPhys.73.515 ↗
49. 10.1002/jcc.2008210.1002/jcc.20082 ↗