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Bytautas, Laimutis, Ruedenberg, Klaus (2009) A priori identification of configurational deadwood. Chemical Physics, 356. 64-75 doi:10.1016/j.chemphys.2008.11.021

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Reference TypeJournal (article/letter/editorial)
TitleA priori identification of configurational deadwood
JournalChemical Physics
AuthorsBytautas, LaimutisAuthor
Ruedenberg, KlausAuthor
Year2009 (February)Volume356
PublisherElsevier BV
DOIdoi:10.1016/j.chemphys.2008.11.021Search in ResearchGate
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Mindat Ref. ID5961906Long-form Identifiermindat:1:5:5961906:8
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Full ReferenceBytautas, Laimutis, Ruedenberg, Klaus (2009) A priori identification of configurational deadwood. Chemical Physics, 356. 64-75 doi:10.1016/j.chemphys.2008.11.021
Plain TextBytautas, Laimutis, Ruedenberg, Klaus (2009) A priori identification of configurational deadwood. Chemical Physics, 356. 64-75 doi:10.1016/j.chemphys.2008.11.021
In(n.d.) Chemical Physics Vol. 356. Elsevier BV

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BYTAUTAS, LAIMUTIS, RUEDENBERG, KLAUS (2002) Electron pairs, localized orbitals and electron correlation. Molecular Physics, 100. 757-781 doi:10.1080/00268970110095165
Bytautas, Laimutis, Ruedenberg, Klaus (2004) Correlation energy extrapolation by intrinsic scaling. III. Compact wave functions. The Journal of Chemical Physics, 121 (22). 10852pp. doi:10.1063/1.1814937
Bytautas, Laimutis, Ruedenberg, Klaus (2004) Correlation energy extrapolation by intrinsic scaling. II. The water and the nitrogen molecule. The Journal of Chemical Physics, 121 (22). 10919pp. doi:10.1063/1.1811604
Bytautas, Laimutis, Ruedenberg, Klaus (2004) Correlation energy extrapolation by intrinsic scaling. I. Method and application to the neon atom. The Journal of Chemical Physics, 121 (22). 10905pp. doi:10.1063/1.1811603
Bytautas, Laimutis, Ivanic, Joseph, Ruedenberg, Klaus (2003) Split-localized orbitals can yield stronger configuration interaction convergence than natural orbitals. The Journal of Chemical Physics, 119 (16). 8217-8224 doi:10.1063/1.1610434
Bytautas, Laimutis, Ruedenberg, Klaus (2008) Correlation energy and dispersion interaction in the ab initio potential energy curve of the neon dimer. The Journal of Chemical Physics, 128 (21). 214308pp. doi:10.1063/1.2927302
Bytautas, Laimutis, Ruedenberg, Klaus (2006) Correlation energy extrapolation by intrinsic scaling. V. Electronic energy, atomization energy, and enthalpy of formation of water. The Journal of Chemical Physics, 124 (17). 174304pp. doi:10.1063/1.2194542
Bytautas, Laimutis, Ruedenberg, Klaus (2009) Ab initio potential energy curve of F2. IV. Transition from the covalent to the van der Waals region: Competition between multipolar and correlation forces. The Journal of Chemical Physics, 130 (20). 204101pp. doi:10.1063/1.3139114
Bytautas, Laimutis, Scuseria, Gustavo E., Ruedenberg, Klaus (2015) Seniority number description of potential energy surfaces: Symmetric dissociation of water, N2, C2, and Be2. The Journal of Chemical Physics, 143 (9). 94105pp. doi:10.1063/1.4929904
Bytautas, Laimutis, Matsunaga, Nikita, Ruedenberg, Klaus (2010) Accurateab initiopotential energy curve of O2. II. Core-valence correlations, relativistic contributions, and vibration-rotation spectrum. The Journal of Chemical Physics, 132 (7). 74307pp. doi:10.1063/1.3298376
Bytautas, Laimutis, Ruedenberg, Klaus (2005) Correlation energy extrapolation by intrinsic scaling. IV. Accurate binding energies of the homonuclear diatomic molecules carbon, nitrogen, oxygen, and fluorine. The Journal of Chemical Physics, 122 (15). 154110pp. doi:10.1063/1.1869493
 
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