Charge-Transfer Excitations within Density Functional Theory: How Accurate Are the Most Recommended Approaches? von Mester, Dávid, Kállay, Mihály

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A Simple Range-Separated Double-Hybrid Density Functional Theory for Excited States von Mester, Dávid, Kállay, Mihály

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Spin-Scaled Range-Separated Double-Hybrid Density Functional Theory for Excited States von Mester, Dávid, Kállay, Mihály

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Accurate Spectral Properties within Double-Hybrid Density Functional Theory: A Spin-Scaled Range-Separated Second-Order Algebraic-Diagrammatic Construction-Based Approach von Mester, Dávid, Kállay, Mihály

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The MRCC program system: Accurate quantum chemistry from water to proteins von Kállay, Mihály, Nagy, Péter R., Mester, Dávid, Rolik, Zoltán, Samu, Gyula, Csontos, József, Csóka, József, Szabó, P. Bernát, Gyevi-Nagy, László, Hégely, Bence, Ladjánszki, István, Szegedy, Lóránt, Ladóczki, Bence, Petrov, Klára, Farkas, Máté, Mezei, Pál D., Ganyecz, Ádám

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Vertical Ionization Potentials and Electron Affinities at the Double-Hybrid Density Functional Level von Mester, Dávid, Kállay, Mihály

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Basis Set Limit of CCSD(T) Energies: Explicit Correlation Versus Density-Based Basis-Set Correction von Mester, Dávid, Kállay, Mihály

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Reduced-Cost Second-Order Algebraic-Diagrammatic Construction Method for Core Excitations von Mester, Dávid, Kállay, Mihály

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Combined Density Functional and Algebraic-Diagrammatic Construction Approach for Accurate Excitation Energies and Transition Moments von Mester, Dávid, Kállay, Mihály

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Double-Hybrid Density Functional Theory for Core Excitations: Theory and Benchmark Calculations von Mester, Dávid, Kállay, Mihály

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Reduced-cost linear-response CC2 method based on natural orbitals and natural auxiliary functions von Mester, Dávid, Nagy, Péter R., Kállay, Mihály

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Reduced-Scaling Approach for Configuration Interaction Singles and Time-Dependent Density Functional Theory Calculations Using Hybrid Functionals von Mester, Dávid, Kállay, Mihály

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Reduced-cost second-order algebraic-diagrammatic construction method for excitation energies and transition moments von Mester, Dávid, Nagy, Péter R., Kállay, Mihály

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Reduced-Scaling Correlation Methods for the Excited States of Large Molecules: Implementation and Benchmarks for the Second-Order Algebraic-Diagrammatic Construction Approach von Mester, Dávid, Nagy, Péter R, Kállay, Mihály

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Basis-Set Limit CCSD(T) Energies for Large Molecules with Local Natural Orbitals and Reduced-Scaling Basis-Set Corrections von Mester, Dávid, Nagy, Péter R, Kállay, Mihály

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Performance of Multilevel Methods for Excited States von Hégely, Bence, Szirmai, Ádám B., Mester, Dávid, Tajti, Attila, Szalay, Péter G., Kállay, Mihály

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Photochemistry of a water-soluble coumarin-based photoswitch von Hessz, Dóra, Kiss, Etelka, Bojtár, Márton, Kunfi, Attila, Mester, Dávid, Kállay, Mihály, Kubinyi, Miklós

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An uracil-linked hydroxyflavone probe for the recognition of ATP von Bojtár, Márton, Janzsó-Berend, Péter Zoltán, Mester, Dávid, Hessz, Dóra, Kállay, Mihály, Kubinyi, Miklós, Bitter, István

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Hydrogen bonding effects on the fluorescence properties of 4′-diethylamino-3-hydroxyflavone in water and water-acetone mixtures von Hessz, Dóra, Bojtár, Márton, Mester, Dávid, Szakács, Zoltán, Bitter, István, Kállay, Mihály, Kubinyi, Miklós

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Adsorption of an active molecule on the surface of halloysite for controlled release application: Interaction, orientation, consequences von Hári, József, Polyák, Péter, Mester, Dávid, Mičušík, Matej, Omastová, Mária, Kállay, Mihály, Pukánszky, Béla

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