Johan M. Carlsson
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View article: The Interoperability Challenge in DFT Workflows Across Implementations
The Interoperability Challenge in DFT Workflows Across Implementations Open
Interoperability and cross-validation remains a significant challenge in the computational materials discovery community. In this context, we introduce a common input/output standard designed for internal translation by various workflow ma…
View article: Scope Meets Screen: Lessons Learned in Designing Composite Visualizations for Marksmanship Training Across Skill Levels
Scope Meets Screen: Lessons Learned in Designing Composite Visualizations for Marksmanship Training Across Skill Levels Open
Marksmanship practices are required in various professions, including police, military personnel, hunters, as well as sports shooters, such as Olympic shooting, biathlon, and modern pentathlon. The current form of training and coaching is …
View article: Autonomous Battery Optimization by Deploying Distributed Experiments and Simulations
Autonomous Battery Optimization by Deploying Distributed Experiments and Simulations Open
Non‐trivial relationships link individual materials properties to device‐level performance. Device optimization therefore calls for new automation approaches beyond the laboratory bench with tight integration of different research methods.…
View article: Materials Acceleration Platforms (MAPs): Accelerating Materials Research and Development to Meet Urgent Societal Challenges
Materials Acceleration Platforms (MAPs): Accelerating Materials Research and Development to Meet Urgent Societal Challenges Open
Climate Change and Materials Criticality challenges are driving urgent responses from global governments. These global responses drive policy to achieve sustainable, resilient, clean solutions with Advanced Materials (AdMats) for industria…
View article: Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange
Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange Open
The Open Databases Integration for Materials Design (OPTIMADE) application programming interface (API) empowers users with holistic access to a growing federation of databases, enhancing the accessibility and discoverability of materials a…
View article: Autonomous battery optimisation by deploying distributed experiments and simulations
Autonomous battery optimisation by deploying distributed experiments and simulations Open
Non-trivial relationships link individual materials properties to device-level performance. Device optimisation therefore calls for new automation approaches beyond the laboratory bench with tight integration of different research methods.…
View article: Reactive molecular dynamics simulations of lithium-ion battery electrolyte degradation
Reactive molecular dynamics simulations of lithium-ion battery electrolyte degradation Open
View article: Reactive molecular dynamics simulations of Lithium-ion battery electrolyte degradation
Reactive molecular dynamics simulations of Lithium-ion battery electrolyte degradation Open
The development of reliable computational methods for novel battery materials has become essential due to the recently intensified research efforts on more sustainable energy storage materials. Here, we use a recently developed framework a…
View article: Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange
Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange Open
The Open Databases Integration for Materials Design (OPTIMADE) application programming interface (API) empowers users with holistic access to a federation of databases, enhancing the accessibility and discoverability of materials and chemi…
View article: Brokering between tenants for an international materials acceleration platform
Brokering between tenants for an international materials acceleration platform Open
The efficient utilization of resources in accelerated materials science necessitates flexible, reconfigurable software-defined research workflows. We demonstrate a brokering approach to modular and asynchronous research orchestration to in…
View article: The Significance of Accelerated Discovery of Advanced Materials to address Societal Challenges
The Significance of Accelerated Discovery of Advanced Materials to address Societal Challenges Open
Societal Challenges demand for Advanced Materials, which in turn promise economical potential. Material Acceleration Platforms (MAPs) will decrease their development time and cost. We comment on implications for science, industry and polic…
View article: Brokering between tenants for an international materials acceleration platform
Brokering between tenants for an international materials acceleration platform Open
The future of materials science is borderless, cooperative, and distributed across the globe. This necessitates flexible, reconfigurable software defined research workflows, which we herein demonstrate by integrating multiple disciplines a…
View article: Influence of [0001] tilt grain boundaries on the destruction of the quantum Hall effect in graphene
Influence of [0001] tilt grain boundaries on the destruction of the quantum Hall effect in graphene Open
The half-integer quantum Hall effect (QHE) is often suppressed in graphene grown by chemical vapor deposition on metals. The reason behind the suppression is unclear, and we hypothesize that it might be connected to extended defects in the…
View article: T cells Viability
T cells Viability Open
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