These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

170 related articles for article (PubMed ID: 30660159)

  • 1. Geminal perturbation theory based on the unrestricted Hartree-Fock wavefunction.
    Földvári D; Tóth Z; Surján PR; Szabados Á
    J Chem Phys; 2019 Jan; 150(3):034103. PubMed ID: 30660159
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Half-Projection of the Strongly Orthogonal Unrestricted Geminals' Product Wave Function.
    Mihálka ZÉ; Surján PR; Szabados Á
    J Chem Theory Comput; 2020 Feb; 16(2):892-903. PubMed ID: 31860306
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Symmetry-Adapted Perturbation with Half-Projection for Spin Unrestricted Geminals.
    Mihálka ZÉ; Surján PR; Szabados Á
    J Chem Theory Comput; 2021 Jul; 17(7):4122-4143. PubMed ID: 34087072
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Spin polynomial similarity transformation for repulsive Hamiltonians: interpolating between coupled cluster and spin-projected unrestricted Hartree-Fock.
    Gomez JA; Degroote M; Zhao J; Qiu Y; Scuseria GE
    Phys Chem Chem Phys; 2017 Aug; 19(33):22385-22394. PubMed ID: 28805863
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Simple and inexpensive perturbative correction schemes for antisymmetric products of nonorthogonal geminals.
    Limacher PA; Ayers PW; Johnson PA; De Baerdemacker S; Van Neck D; Bultinck P
    Phys Chem Chem Phys; 2014 Mar; 16(11):5061-5. PubMed ID: 24488215
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Accurate Prediction of Hyperfine Coupling Tensors for Main Group Elements Using a Unitary Group Based Rigorously Spin-Adapted Coupled-Cluster Theory.
    Datta D; Gauss J
    J Chem Theory Comput; 2019 Mar; 15(3):1572-1592. PubMed ID: 30698956
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Basis set and electron correlation effects on the polarizability and second hyperpolarizability of model open-shell pi-conjugated systems.
    Champagne B; Botek E; Nakano M; Nitta T; Yamaguchi K
    J Chem Phys; 2005 Mar; 122(11):114315. PubMed ID: 15839724
    [TBL] [Abstract][Full Text] [Related]  

  • 8. SS(p)G: a strongly orthogonal geminal method with relaxed strong orthogonality.
    Cagg BA; Rassolov VA
    J Chem Phys; 2014 Oct; 141(16):164112. PubMed ID: 25362277
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Finite-temperature coupled-cluster, many-body perturbation, and restricted and unrestricted Hartree-Fock study on one-dimensional solids: Luttinger liquids, Peierls transitions, and spin- and charge-density waves.
    Hermes MR; Hirata S
    J Chem Phys; 2015 Sep; 143(10):102818. PubMed ID: 26374011
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Spin Symmetry and Size Consistency of Strongly Orthogonal Geminals.
    Jeszenszki P; Surján PR; Szabados Á
    J Chem Theory Comput; 2015 Jul; 11(7):3096-103. PubMed ID: 26575746
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Finding symmetry breaking Hartree-Fock solutions: The case of triplet instability.
    Tóth Z; Pulay P
    J Chem Phys; 2016 Oct; 145(16):164102. PubMed ID: 27802634
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Explicitly correlated second-order Møller-Plesset perturbation theory for unrestricted Hartree-Fock reference functions with exact satisfaction of cusp conditions.
    Bokhan D; Bernadotte S; Ten-No S
    J Chem Phys; 2009 Aug; 131(8):084105. PubMed ID: 19725606
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Constrained-pairing mean-field theory. IV. Inclusion of corresponding pair constraints and connection to unrestricted Hartree-Fock theory.
    Tsuchimochi T; Henderson TM; Scuseria GE; Savin A
    J Chem Phys; 2010 Oct; 133(13):134108. PubMed ID: 20942524
    [TBL] [Abstract][Full Text] [Related]  

  • 14. On the nature of electron correlation in C60.
    Stück D; Baker TA; Zimmerman P; Kurlancheek W; Head-Gordon M
    J Chem Phys; 2011 Nov; 135(19):194306. PubMed ID: 22112081
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Electron correlation within the relativistic no-pair approximation.
    Almoukhalalati A; Knecht S; Jensen HJ; Dyall KG; Saue T
    J Chem Phys; 2016 Aug; 145(7):074104. PubMed ID: 27544084
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Constrained active space unrestricted mean-field methods for controlling spin-contamination.
    Tsuchimochi T; Scuseria GE
    J Chem Phys; 2011 Feb; 134(6):064101. PubMed ID: 21322655
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Second-Order Perturbation Theory with Spin-Symmetry-Projected Hartree-Fock.
    Tsuchimochi T; Ten-No SL
    J Chem Theory Comput; 2019 Dec; 15(12):6688-6702. PubMed ID: 31661264
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Density-functional theory-based chemical reactivity indices in the Hartree-Fock method. I. Unrestricted Hartree-Fock method for a noninteger number of electrons.
    Balawender R; Geerlings P
    J Chem Phys; 2005 Sep; 123(12):124102. PubMed ID: 16392470
    [TBL] [Abstract][Full Text] [Related]  

  • 19. New coupled cluster approaches based on the unrestricted Hartree-Fock reference for treating molecules with multireference character.
    Shen J; Xu E; Kou Z; Li S
    Phys Chem Chem Phys; 2011 May; 13(19):8795-804. PubMed ID: 21448471
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Geminal model chemistry II. Perturbative corrections.
    Rassolov VA; Xu F; Garashchuk S
    J Chem Phys; 2004 Jun; 120(22):10385-94. PubMed ID: 15268066
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 9.