The DIRAC code for relativistic molecular calculations by Saue, Trond, Bast, Radovan, Gomes, André Severo Pereira, Jensen, Hans Jørgen Aa, Visscher, Lucas, Aucar, Ignacio Agustín, Di Remigio, Roberto, Dyall, Kenneth G., Eliav, Ephraim, Fasshauer, Elke, Fleig, Timo, Halbert, Loïc, Hedegård, Erik Donovan, Helmich-Paris, Benjamin, Iliaš, Miroslav, Jacob, Christoph R., Knecht, Stefan, Laerdahl, Jon K., Vidal, Marta L., Nayak, Malaya K., Olejniczak, Małgorzata, Olsen, Jógvan Magnus Haugaard, Pernpointner, Markus, Senjean, Bruno, Shee, Avijit, Sunaga, Ayaki, van Stralen, Joost N. P.

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A simple scheme for magnetic balance in four-component relativistic Kohn-Sham calculations of nuclear magnetic resonance shielding constants in a Gaussian basis by Olejniczak, Małgorzata, Bast, Radovan, Saue, Trond, Pecul, Magdalena

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Dalton Project: A Python platform for molecular- and electronic-structure simulations of complex systems by Olsen, Jógvan Magnus Haugaard, Reine, Simen, Vahtras, Olav, Kjellgren, Erik, Reinholdt, Peter, Hjorth Dundas, Karen Oda, Li, Xin, Cukras, Janusz, Ringholm, Magnus, Hedegård, Erik D., Di Remigio, Roberto, List, Nanna H., Faber, Rasmus, Cabral Tenorio, Bruno Nunes, Bast, Radovan, Pedersen, Thomas Bondo, Rinkevicius, Zilvinas, Sauer, Stephan P. A., Mikkelsen, Kurt V., Kongsted, Jacob, Coriani, Sonia, Ruud, Kenneth, Helgaker, Trygve, Jensen, Hans Jørgen Aa, Norman, Patrick

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Arbitrary-Order Density Functional Response Theory from Automatic Differentiation by Ekström, Ulf, Visscher, Lucas, Bast, Radovan, Thorvaldsen, Andreas J., Ruud, Kenneth

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A FAIRer future by Bast, Radovan

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Analytic cubic and quartic force fields using density-functional theory by Ringholm, Magnus, Jonsson, Dan, Bast, Radovan, Gao, Bin, Thorvaldsen, Andreas J, Ekström, Ulf, Helgaker, Trygve, Ruud, Kenneth

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Progress toward the first observation of parity violation in chiral molecules by high-resolution laser spectroscopy by Darquié, Benoît, Stoeffler, Clara, Shelkovnikov, Alexander, Daussy, Christophe, Amy-Klein, Anne, Chardonnet, Christian, Zrig, Samia, Guy, Laure, Crassous, Jeanne, Soulard, Pascale, Asselin, Pierre, Huet, Thérèse R., Schwerdtfeger, Peter, Bast, Radovan, Saue, Trond

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Relativistic adiabatic time-dependent density functional theory using hybrid functionals and noncollinear spin magnetization by Bast, Radovan, Jensen, Hans Jørgen Aa, Saue, Trond

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Analysis of parity violation in chiral molecules by Bast, Radovan, Koers, Anton, Gomes, André Severo Pereira, Iliaš, Miroslav, Visscher, Lucas, Schwerdtfeger, Peter, Saue, Trond

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The First and Second Static Electronic Hyperpolarizabilities of Zigzag Boron Nitride Nanotubes. An ab Initio Approach through the Coupled Perturbed Kohn–Sham Scheme by Orlando, Roberto, Bast, Radovan, Ruud, Kenneth, Ekström, Ulf, Ferrabone, Matteo, Kirtman, Bernard, Dovesi, Roberto

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Erratum: “A simple scheme for magnetic balance in four-component relativistic Kohn–Sham calculations of nuclear magnetic resonance shielding constants in a Gaussian basis” [J. Chem... by Olejniczak, Małgorzata, Bast, Radovan, Saue, Trond, Pecul, Magdalena

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Parity nonconservation contribution to the nuclear magnetic resonance shielding constants of chiral molecules: A four-component relativistic study by Bast, Radovan, Schwerdtfeger, Peter, Saue, Trond

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Five-Photon Absorption and Selective Enhancement of Multiphoton Absorption Processes by Friese, Daniel H, Bast, Radovan, Ruud, Kenneth

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The accuracy of density functionals for electric field gradients. Test calculations for ScX, CuX and GaX (X=F, Cl, Br, I, H and Li) by Bast, Radovan, Schwerdtfeger, Peter

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Chiral oxorhenium(v) complexes as candidates for the experimental observation of molecular parity violation: a structural, synthetic and theoretical study by DE MONTIGNY, Frederic, BAST, Radovan, SEVERO PEREIRA GOMES, Andre, PILET, Guillaume, VANTHUYNE, Nicolas, ROUSSEL, Christian, GUY, Laure, SCHWERDTFEGER, Peter, SAUE, Trond, CRASSOUS, Jeanne

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Spatial Contributions to Nuclear Magnetic Shieldings by Jinger, Rahul Kumar, Fliegl, Heike, Bast, Radovan, Dimitrova, Maria, Lehtola, Susi, Sundholm, Dage

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Charge-Transfer Excitations in Uranyl Tetrachloride ([UO2Cl4]2–): How Reliable are Electronic Spectra from Relativistic Time-Dependent Density Functional Theory? by Tecmer, Paweł, Bast, Radovan, Ruud, Kenneth, Visscher, Lucas

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Multiconfigurational Self-Consistent Field Calculations of the Magnetically Induced Current Density Using Gauge-Including Atomic Orbitals by Pathak, Shubhrodeep, Bast, Radovan, Ruud, Kenneth

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Calculation of the first static hyperpolarizability tensor of three-dimensional periodic compounds with a local basis set: A comparison of LDA, PBE, PBE0, B3LYP, and HF results by Orlando, Roberto, Lacivita, Valentina, Bast, Radovan, Ruud, Kenneth

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All-Metal Aromaticity: Revisiting the Ring Current Model among Transition Metal Clusters by Badri, Zahra, Pathak, Shubhrodeep, Fliegl, Heike, Rashidi-Ranjbar, Parviz, Bast, Radovan, Marek, Radek, Foroutan-Nejad, Cina, Ruud, Kenneth

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