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Publications by Heiner Schröder

Efficient Determination of Accurate Atomic Polarizabilities for Polarizeable Embedding Calculations

Journal of Computational Chemistry

Computational Mathematics

English

Related publications

Atomic Origins of Molecular Polarizabilities

Canadian Journal of Chemistry

Organic Chemistry

English

An Assessment of Initial Guesses for Self-Consistent Field Calculations. Superposition of Atomic Potentials: Simple Yet Efficient

Journal of Chemical Theory and Computation

Theoretical Chemistry

Computer Science Applications

English

Accurate Determination of Atomic Structure of Multiwalled Carbon Nanotubes by Nondestructive Nanobeam Electron Diffraction

Applied Physics Letters

English

Improved Embedding Ab Initio Model Potentials for Embedded Cluster Calculations†

Journal of Physical Chemistry A

Theoretical Chemistry

English

Accurate Nonlinear Resistive FET Modeling for IMD Calculations

English

High Accuracy for Atomic Calculations Involving Logarithmic Sums

Physical Review A

English

Heterogeneous Network Embedding Enabling Accurate Disease Association Predictions

BMC Medical Genomics

English

Toward Efficient GW Calculations Using Numerical Atomic Orbitals: Benchmarking and Application to Molecular Dynamics Simulations

English

Accurate Mass Determination of Organotrifluoroborates

Journal of the American Society for Mass Spectrometry

Structural Biology

English