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D

Daniel Kats

University of Stuttgart

24H指数
84论文数
1.9K被引数
收录论文 36
发表时间
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Transcorrelated Theory with Pseudopotentials自相关理论中的赝势方法
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-05-13
err0
errOAAI
errSimula, Kristoffer; Christlmaier, Evelin Martine Corvid; Filip, Maria-Andreea; Haupt, J. Philip; Kats, Daniel; Lopez-Rios, Pablo; Alavi, Ali
err分享
err收藏
On the applicability of CCSD(T) for dispersion interactions in large conjugated systems
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2025-03-21
err0
errOAAI
errLambie, S.; Kats, D.; Usvyat, D.; Alavi, A.
err分享
err收藏
Transcorrelated methods applied to second row elements
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2025-02-13
err0
errOAAI
errFilip, Maria-Andreea; Rios, Pablo Lopez; Haupt, J. Philip; Christlmaier, Evelin Martine Corvid; Kats, Daniel; Alavi, Ali
err分享
err收藏
Two determinant distinguishable cluster
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2024-03-25
err0
errOAAI
errSchraivogel, Thomas; Kats, Daniel
err分享
err收藏
Stochastic and low-scaling techniques: general discussion
errFARADAY DISCUSSIONS
IF3.1
err2024-01-01
err0
PREAI
errAlavi, Ali; Allen, Marcus; Atalar, Kemal; Berkelbach, Timothy C.; Booth, George H.; Burton, Hugh G. A.; Chan, Garnet Kin-Lic; Craciunescu, Luca; Danilov, Don; Dobrautz, Werner; Evangelista, Francesco A.; Filip, Maria-Andreea; Giner, Emmanuel; Greene-Diniz, Gabriel; Gruneis, Andreas; Guo, Yang; Harsha, Gaurav; Ibrahim, Basil; Kapil, Venkat; Kats, Daniel; Knowles, Peter J.; Lepetit, Marie-Bernadette; Liao, Ke; Li Manni, Giovanni; Loos, Pierre-Francois; Magnusson, Erika; Marie, Antoine; Mejuto-Zaera, Carlos; Neese, Frank; Nejad, Arman; Neufeld, Verena A.; Pernal, Katarzyna; Plasser, Felix; Prentice, Andrew W.; Ravindran, Visagan; Rehman, Umatur; Reiher, Markus; Schilling, Christian; Scuseria, Gustavo; Shee, James; Shi, Benjamin X.; Szenes, Kalman; Tew, David P.; Thom, Alex J. W.; Wang, Zikuan; Zgid, Dominika; Zhu, Andrew; Zwijnenburg, Martijn A.
err分享
err收藏
Orbital optimisation in xTC transcorrelated methods
errFARADAY DISCUSSIONS
IF3.1
err2024-01-01
err2
errOAAI
errKats, Daniel; Christlmaier, Evelin M. C.; Schraivogel, Thomas; Alavi, Ali
err分享
err收藏
xTC: An efficient treatment of three-body interactions in transcorrelated methods
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-07-06
err9
errOAAI
errChristlmaier, Evelin Martine; Schraivogel, Thomas; Rios, Pablo Lopez; Alavi, Ali; Kats, Daniel
err分享
err收藏
Transcorrelated coupled cluster methods. II. Molecular systems
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2023-06-01
err10
errOAAI
errSchraivogel, Thomas; Christlmaier, Evelin Martine; Rios, Pablo Lopez; Alavi, Ali; Kats, Daniel
err分享
err收藏
Density Matrix Renormalization Group for Transcorrelated Hamiltonians: Ground and Excited States in Molecules
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-03-13
err18
PREAI
errLiao, Ke; Zhai, Huanchen; Christlmaier, Evelin Martine; Schraivogel, Thomas; Rios, Pablo Lopez; Kats, Daniel; Alavi, Ali
err分享
err收藏
Resolution of Electronic States in Heisenberg Cluster Models within the Unitary Group Approach
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2023-02-03
err5
errOAAI
errLi Manni, Giovanni; Kats, Daniel; Liebermann, Niklas
err分享
err收藏
Combined unitary and symmetric group approach applied to low-dimensional Heisenberg spin systems
errPHYSICAL REVIEW B
IF3.7
err2022-05-18
err12
errOAAI
errDobrautz, Werner; Katukuri, Vamshi M.; Bogdanov, Nikolay A.; Kats, Daniel; Li Manni, Giovanni; Alavi, Ali
err分享
err收藏
FCIQMC-Tailored Distinguishable Cluster Approach: Open-Shell Systems
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2022-05-06
err10
errOAAI
errVitale, Eugenio; Li Manni, Giovanni; Alavi, Ali; Kats, Daniel
err分享
err收藏
Full configuration interaction quantum Monte Carlo treatment of fragments embedded in a periodic mean field
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-04-18
err11
PREAI
errChristlmaier, Evelin Martine; Kats, Daniel; Alavi, Ali; Usvyat, Denis
err分享
err收藏
Transcorrelated coupled cluster methods
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-11-15
err26
errOAAI
errSchraivogel, Thomas; Cohen, Aron J.; Alavi, Ali; Kats, Daniel
err分享
err收藏
Accuracy of the distinguishable cluster approximation for triple excitations for open-shell molecules and excited states
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2021-08-09
err8
errOAAI
errSchraivogel, Thomas; Kats, Daniel
err分享
err收藏
Towards efficient and accurate ab initio solutions to periodic systems via transcorrelation and coupled cluster theory
errPHYSICAL REVIEW RESEARCH
IF4.2
err2021-07-20
err29
errOAAI
errLiao, Ke; Schraivogel, Thomas; Luo, Hongjun; Kats, Daniel; Alavi, Ali
err分享
err收藏
Fragment-Based Restricted Active Space Configuration Interaction with Second-Order Corrections Embedded in Periodic Hartree-Fock Wave Function
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2020-10-19
err13
PREAI
errLin, Hung-Hsuan; Maschio, Lorenzo; Kats, Daniel; Usvyat, Denis; Heine, Thomas
err分享
err收藏
FCIQMC-Tailored Distinguishable Cluster Approach
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2020-07-28
err27
errOAAI
errVitale, Eugenio; Alavi, Ali; Kats, Daniel
err分享
err收藏
The Molpro quantum chemistry package
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-04-13
err863
errOAAI
errWerner, Hans-Joachim; Knowles, Peter J.; Manby, Frederick R.; Black, Joshua A.; Doll, Klaus; Hesselmann, Andreas; Kats, Daniel; Koehn, Andreas; Korona, Tatiana; Kreplin, David A.; Ma, Qianli; Miller, Thomas F., III; Mitrushchenkov, Alexander; Peterson, Kirk A.; Polyak, Iakov; Rauhut, Guntram; Sibaev, Marat
err分享
err收藏
Multi-state local complete active space second-order perturbation theory using pair natural orbitals (PNO-MS-CASPT2)
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2019-06-05
err23
PREAI
errKats, Daniel; Werner, Hans-Joachim
err分享
err收藏

研究方向

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