Search Results - "SHAVITT, I" :: K.UTB vyhledávací portál | TBU Library Retrieval Portal

Flood forecasting with machine learning models in an operational framework

Flood forecasting with machine learning models in an operational framework

by Nevo, Sella, Morin, Efrat, Gerzi Rosenthal, Adi, Metzger, Asher, Barshai, Chen, Weitzner, Dana, Voloshin, Dafi, Kratzert, Frederik, Elidan, Gal, Dror, Gideon, Begelman, Gregory, Nearing, Grey, Shalev, Guy, Noga, Hila, Shavitt, Ira, Yuklea, Liora, Royz, Moriah, Giladi, Niv, Peled Levi, Nofar, Reich, Ofir, Gilon, Oren, Maor, Ronnie, Timnat, Shahar, Shechter, Tal, Anisimov, Vladimir, Gigi, Yotam, Levin, Yuval, Moshe, Zach, Ben-Haim, Zvika, Hassidim, Avinatan, Matias, Yossi
Published in Hydrology and earth system sciences (05.08.2022)

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Journal Article

High-level multireference methods in the quantum-chemistry program system COLUMBUS : Analytic MR-CISD and MR-AQCC gradients and MR-AQCC-LRT for excited states, GUGA spin-orbit CI and parallel CI density

High-level multireference methods in the quantum-chemistry program system COLUMBUS : Analytic MR-CISD and MR-AQCC gradients and MR-AQCC-LRT for excited states, GUGA spin-orbit CI and parallel CI density

by LISCHKA, Hans, SHEPARD, Ron, ZHIYONG ZHANG, PITZER, Russell M, SHAVITT, Isaiah, DALLOS, Michal, MÜLLER, Thomas, SZALAY, Péter G, SETH, Michael, KEDZIORA, Gary S, YABUSHITA, Satoshi
Published in PCCP. Physical chemistry chemical physics (Print) (2001)

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Conference Proceeding Journal Article

The iterative calculation of several of the lowest or highest eigenvalues and corresponding eigenvectors of very large symmetric matrices

The iterative calculation of several of the lowest or highest eigenvalues and corresponding eigenvectors of very large symmetric matrices

by Shavitt, I, Bender, C.F, Pipano, A, Hosteny, R.P
Published in Journal of computational physics (1973)

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Journal Article

Low-lying .pi.-electron states of trans-butadiene

Low-lying .pi.-electron states of trans-butadiene

by Dunning, Thom. H, Hosteny, R. P, Shavitt, I
Published in Journal of the American Chemical Society (01.07.1973)

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Journal Article

An iterative procedure for the calculation of the lowest real eigenvalue and eigenvector of a nonsymmetric matrix

An iterative procedure for the calculation of the lowest real eigenvalue and eigenvector of a nonsymmetric matrix

by Bender, C.F, Shavitt, I
Published in Journal of computational physics (1970)

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Journal Article

Correlation energy in triplet states - Comparison of many-body perturbation theory and configuration interaction for CH2 and O2

Correlation energy in triplet states - Comparison of many-body perturbation theory and configuration interaction for CH2 and O2

by Carsky, P., Svrcek, M., Hubac, I., Brown, F. B., Shavitt, I.
Published in Chemical physics letters (01.01.1982)

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Journal Article

The Aκ and Bκ approximate CI methods comment on a paper by Maynau and Heully

The Aκ and Bκ approximate CI methods comment on a paper by Maynau and Heully

by SHAVITT, I
Published in Chemical physics letters (1992)

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Journal Article

Reducing I/O costs for the eigenvalue procedure in large-scale configuration interaction calculations

Reducing I/O costs for the eigenvalue procedure in large-scale configuration interaction calculations

by Shepard, Ron, Shavitt, Isaiah, Lischka, Hans
Published in Journal of computational chemistry (01.08.2002)

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Journal Article

Stabilities of hydrocarbons and carbocations. I: A comparison of augmented 6-31G, 6-311G, and correlation consistent basis sets

Stabilities of hydrocarbons and carbocations. I: A comparison of augmented 6-31G, 6-311G, and correlation consistent basis sets

by DEL BENE, J. E, AUE, D. H, SHAVITT, I
Published in Journal of the American Chemical Society (1992)

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Journal Article

Multireference configuration interaction treatment of potential energy surfaces: symmetric dissociation of H2O in a double-zeta basis

Multireference configuration interaction treatment of potential energy surfaces: symmetric dissociation of H2O in a double-zeta basis

by BROWN, F. B, SHAVITT, I, SHEPARD, R
Published in Chemical physics letters (23.03.1984)

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Journal Article

Comparison of theoretical methods for the determination of the protonation and deprotonation energies of NH sub 3 , H sub 2 O, HF, PH sub 3 , H sub 2 S, HCl, and HCN

Comparison of theoretical methods for the determination of the protonation and deprotonation energies of NH sub 3 , H sub 2 O, HF, PH sub 3 , H sub 2 S, HCl, and HCN

by Del Bene, J.E., Shavitt, I.
Published in Journal of physical chemistry (1952) (12.07.1990)

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Journal Article

Ab initio study of spiropentadiene, C5H4

Ab initio study of spiropentadiene, C5H4

by Shavitt, Isaiah, Ewing, David W, Del Bene, Janet E
Published in Journal of the American Chemical Society (01.11.1991)

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Journal Article

Accurate ab initio calculations on the singlet-triplet separation in methylene

Accurate ab initio calculations on the singlet-triplet separation in methylene

by Bauschlicher, Charles W, Shavitt, Isaiah
Published in Journal of the American Chemical Society (01.02.1978)

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Journal Article

Comparison of theoretical methods for the determination of the protonation and deprotonation energies of NH3, H2O, HF, PH3, H2S, HCl, and HCN

Comparison of theoretical methods for the determination of the protonation and deprotonation energies of NH3, H2O, HF, PH3, H2S, HCl, and HCN

by DEL BENE, J. E, SHAVITT, I
Published in Journal of physical chemistry (1952) (12.07.1990)

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Conference Proceeding

Vectorizing a sequence of conditional branches: The calculation of the class index of two-electron repulsion integrals on cray computers

Vectorizing a sequence of conditional branches: The calculation of the class index of two-electron repulsion integrals on cray computers

by Ernenwein, René, Benard, Marc, Shavitt, Isaiah
Published in Computer physics communications (1988)

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Journal Article

Structure, binding energy, and vibrational frequencies of CH3CN...HCI

Structure, binding energy, and vibrational frequencies of CH3CN...HCI

by DEL BENE, J. E, METTEE, H. D, SHAVITT, I
Published in Journal of physical chemistry (1952) (1991)

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Journal Article

Basis-set effects on computed acid-based interaction energies using the Dunning correlation-consistent polarized split-valence basis sets: Molecular interactions

Basis-set effects on computed acid-based interaction energies using the Dunning correlation-consistent polarized split-valence basis sets: Molecular interactions

by DEL BENE, J. E, SHAVITT, I
Published in Journal of molecular structure. Theochem (1994)

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Journal Article

The Attraction of Minicomputers

The Attraction of Minicomputers

by Shavitt, Isaiah, Tobin, Frank
Published in Science (American Association for the Advancement of Science) (26.11.1976)

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Journal Article

Invariance of inner shell correlation energy with geometry changes in a polyatomic molecule

Invariance of inner shell correlation energy with geometry changes in a polyatomic molecule

by Pipano, A., Gilman, R.R., Shavitt, I.
Published in Chemical physics letters (15.04.1970)

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Journal Article

Large-scale configuration interaction calculations on the π-electron states of benzene

Large-scale configuration interaction calculations on the π-electron states of benzene

by Hay, P.J., Shavitt, I.
Published in Chemical physics letters (01.01.1973)

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Journal Article