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Volumn 77, Issue 8, 2008, Pages

Nodal Pulay terms for accurate diffusion quantum Monte Carlo forces

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EID: 40849147182     PISSN: 10980121     EISSN: 1550235X     Source Type: Journal    
DOI: 10.1103/PhysRevB.77.085111     Document Type: Article
Times cited : (16)

References (24)
  • 3
    • 34547564932 scopus 로고
    • PHRVAO 0031-899X 10.1103/PhysRev.56.340
    • R. P. Feynman, Phys. Rev. PHRVAO 0031-899X 10.1103/PhysRev.56.340 56, 340 (1939).
    • (1939) Phys. Rev. , vol.56 , pp. 340
    • Feynman, R.P.1
  • 4
    • 84931507903 scopus 로고
    • MOPHAM 0026-8976 10.1080/00268976900100941
    • P. Pulay, Mol. Phys. MOPHAM 0026-8976 10.1080/00268976900100941 17, 197 (1969).
    • (1969) Mol. Phys. , vol.17 , pp. 197
    • Pulay, P.1
  • 6
    • 0034622745 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1286598
    • R. Assaraf and M. Caffarel, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1286598 113, 4028 (2000);
    • (2000) J. Chem. Phys. , vol.113 , pp. 4028
    • Assaraf, R.1    Caffarel, M.2
  • 7
    • 0348207641 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1621615
    • R. Assaraf and M. Caffarel, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1621615 119, 10536 (2003);
    • (2003) J. Chem. Phys. , vol.119 , pp. 10536
    • Assaraf, R.1    Caffarel, M.2
  • 9
    • 22544474999 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1924690
    • M. W. Lee, M. Mella, and A. Rappe, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1924690 122, 244103 (2005).
    • (2005) J. Chem. Phys. , vol.122 , pp. 244103
    • Lee, M.W.1    Mella, M.2    Rappe, A.3
  • 10
    • 18044384242 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.94.036404
    • S. Chiesa, D. M. Ceperley, and S. Zhang, Phys. Rev. Lett. PRLTAO 0031-9007 10.1103/PhysRevLett.94.036404 94, 036404 (2005).
    • (2005) Phys. Rev. Lett. , vol.94 , pp. 036404
    • Chiesa, S.1    Ceperley, D.M.2    Zhang, S.3
  • 12
    • 0005548471 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.480997
    • F. Schautz and H.-J. Flad, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.480997 112, 4421 (2000).
    • (2000) J. Chem. Phys. , vol.112 , pp. 4421
    • Schautz, F.1    Flad, H.-J.2
  • 13
    • 34548855740 scopus 로고    scopus 로고
    • PLEEE8 1063-651X 10.1103/PhysRevE.76.036707
    • A. Badinski and R. J. Needs, Phys. Rev. E PLEEE8 1063-651X 10.1103/PhysRevE.76.036707 76, 036707 (2007).
    • (2007) Phys. Rev. e , vol.76 , pp. 036707
    • Badinski, A.1    Needs, R.J.2
  • 14
    • 0001075041 scopus 로고
    • JSTPBS 0022-4715 10.1007/BF01030009
    • D. M. Ceperley, J. Stat. Phys. JSTPBS 0022-4715 10.1007/BF01030009 63, 1237 (1991);
    • (1991) J. Stat. Phys. , vol.63 , pp. 1237
    • Ceperley, D.M.1
  • 15
    • 0001517420 scopus 로고    scopus 로고
    • see also PRBMDO 0163-1829 10.1103/PhysRevB.60.4558
    • see also W. M. C. Foulkes, R. Q. Hood, and R. J. Needs, Phys. Rev. B PRBMDO 0163-1829 10.1103/PhysRevB.60.4558 60, 4558 (1999).
    • (1999) Phys. Rev. B , vol.60 , pp. 4558
    • Foulkes, W.M.C.1    Hood, R.Q.2    Needs, R.J.3
  • 17
    • 18744379498 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1888569
    • J. R. Trail and R. J. Needs, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1888569 122, 174109 (2005);
    • (2005) J. Chem. Phys. , vol.122 , pp. 174109
    • Trail, J.R.1    Needs, R.J.2
  • 18
    • 22944435873 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1829049
    • J. R. Trail and R. J. Needs, J. Chem. Phys. JCPSA6 0021-9606 10.1063/1.1829049 122, 014112 (2005);
    • (2005) J. Chem. Phys. , vol.122 , pp. 014112
    • Trail, J.R.1    Needs, R.J.2
  • 19
    • 40849101058 scopus 로고    scopus 로고
    • see also
    • see also www.tcm.phy.cam.ac.uk/~mdt26/casino2_pseudopotentials.html


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.