Susi Lehtola - Concepedia

Author

Susi Lehtola

University of Helsinki ORCID

Also Known As

J. Lehtola, Jussi Lehtola, Lehtola, Susi, Rackers, Joshua A., S. Lehtola, Susi Lehtola

105

Publications

6.7K

Citations

H-Index

Concepts

All Affiliations

University of Helsinki Molecular Sciences Software Institute Aalto University Lawrence Berkeley National Laboratory University of Iceland

About

Susi Lehtola is an author at University of Helsinki specializing in quantum chemistry, natural sciences, and computational chemistry.

Top Concepts

#	Concept	H-Index	Publications	Citations
1	Engineering	19	22	2.2K
2	Natural Sciences	19	20	2.2K
3	Chemistry	19	19	2K
4	Applied Physics	10	10	498
5	Medicine	1	1	25

Susi Lehtola

Publications

6.4K

Citations

H-Index

Page 1

	Year	Citations
Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package Evgeny Epifanovsky, Andrew T. B. Gilbert, Xintian Feng, The Journal of Chemical Physics	2021	1.3K
Recent developments in the P<scp>y</scp>SCF program package Qiming Sun, Xing Zhang, Samragni Banerjee, The Journal of Chemical Physics EngineeringMachine LearningComputational ChemistryChemistrySoftware Analysis	2020	1K
P <scp>SI4</scp> 1.4: Open-source software for high-throughput quantum chemistry Daniel G. A. Smith, Lori A. Burns, Andrew C. Simmonett, The Journal of Chemical Physics	2020	923
Recent developments in libxc — A comprehensive library of functionals for density functional theory Susi Lehtola, Conrad Steigemann, Micael J. T. Oliveira, SoftwareX	2017	840
The OpenMolcas <i>Web</i> : A Community-Driven Approach to Advancing Computational Chemistry Giovanni Li Manni, Ignacio Fdez. Galván, Ali Alavi, Journal of Chemical Theory and Computation	2023	286
CASSCF with Extremely Large Active Spaces Using the Adaptive Sampling Configuration Interaction Method Daniel S. Levine, Diptarka Hait, Norm M. Tubman, Journal of Chemical Theory and Computation Sampling (Signal Processing)EngineeringComputational ChemistryEnergy MinimizationMolecular Dynamics	2020	156
Microscopic structure of water at elevated pressures and temperatures Christoph J. Sahle, Christian Sternemann, Christian Schmidt, Proceedings of the National Academy of Sciences	2013	153
Pipek–Mezey Orbital Localization Using Various Partial Charge Estimates Susi Lehtola, Hannes Jónsson Journal of Chemical Theory and Computation Electron DensityOrbit DeterminationLocalized Excited StateEngineeringPhysics	2014	110
Benchmarking Magnetizabilities with Recent Density Functionals Susi Lehtola, Maria Dimitrova, Heike Fliegl, Journal of Chemical Theory and Computation Magnetic PropertiesOlder FunctionalsEngineeringMagnetic ResonanceComputational Chemistry	2021	98
Unitary Optimization of Localized Molecular Orbitals Susi Lehtola, Hannes Jónsson Journal of Chemical Theory and Computation Quantum ScienceUnified FormalismConjugate Gradient AlgorithmFourth MomentEngineering	2013	96

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