1963 …2020

Research output per year

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Research Output

Bayesian error estimation in density functional theory

Christensen, R., Bligaard, T. & Jacobsen, K. W., 2020, Uncertainty Quantification in Multiscale Materials Modeling. Woodhead Publishing, p. 77-91

Research output: Chapter in Book/Report/Conference proceedingBook chapterResearchpeer-review

Definition of a scoring parameter to identify low-dimensional materials components

Larsen, P. M., Pandey, M., Strange, M. & Jacobsen, K. W., 2019, In : Physical Review Materials. 3, 3, 11 p., 034003.

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
File
267 Downloads (Pure)

High-Entropy Alloys as a Discovery Platform for Electrocatalysis

Batchelor, T. A. A., Pedersen, J. K., Winther, S. H., Castelli, I. E., Jacobsen, K. W. & Rossmeisl, J., 2019, In : Joule. 3, 3, p. 834-845

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
File
84 Downloads (Pure)

Local Bayesian optimizer for atomic structures

Garijo del Río, E., Mortensen, J. J. & Jacobsen, K. W., 2019, In : Physical Review B. 100, 10, 9 p., 104103.

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
File
157 Downloads (Pure)

Materials property prediction using symmetry-labeled graphs as atomic position independent descriptors

Jørgensen, P. B., Garijo del Río, E., Schmidt, M. N. & Jacobsen, K. W., 2019, In : Physical Review B. 100, 10, 12 p., 104114.

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
File
175 Downloads (Pure)

Projects