Sergei Kalinin

Sergei Kalinin


Research Focus & Metrics

Academic Career Length

34Years (1993-Present)

(Calculated once Scilit publication data is synced: current year − year of first publication + 1)

Representative Publications

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25 January 2009 in Nature Materials
Verified
Journal Article
Closed access
PDF file
JSJan Seidel
Jan Seidel
LML. W. Martin
L. W. Martin
QHQ. He
Q. He
QZQ. Zhan
Q. Zhan
YCYing-Hao Chu
Ying-Hao Chu
RRR. Ramesh
R. Ramesh

12 November 2020 in npj Computational Materials
Verified
Journal Article
Open access
PDF file
KCKamal Choudhary
Kamal Choudhary
KGKevin F. Garrity
Kevin F. Garrity
ARAndrew Reid
Andrew Reid
BDBrian DeCost
Brian DeCost
ABAdam Biacchi
Adam Biacchi
FTFrancesca Tavazza
Francesca Tavazza
The Joint Automated Repository for Various Integrated Simulations (JARVIS) is an integrated infrastructure to accelerate materials discovery and design using density functional theory (DFT), classical force-fields (FF), and machine learning (ML) techniques. JARVIS is motivated by the Materials Genome Initiative (MGI) principles of developing open-access databases and tools to reduce the cost and development time of materials discovery, optimization, and deployment. The major features of JARVIS are: JARVIS-DFT, JARVIS-FF, JARVIS-ML, and JARVIS-tools. To date, JARVIS consists of ≈40,000 materials and ≈1 million calculated properties in JARVIS-DFT, ≈500 materials and ≈110 force-fields in JARVIS-FF, and ≈25 ML models for material-property predictions in JARVIS-ML, all of which are continuously expanding. JARVIS-tools provides scripts and workflows for running and analyzing various simulations. We compare our computational data to experiments or high-fidelity computational methods wherever applicable to evaluate error/uncertainty in predictions. In addition to the existing workflows, the infrastructure can support a wide variety of other technologically important applications as part of the data-driven materials design paradigm. The JARVIS datasets and tools are publicly available at the website: https://jarvis.nist.gov.

29 August 2010 in Nature Nanotechnology
Verified
Journal Article
Closed access
PDF file
NBN. Balke
N. Balke
SJS. Jesse
S. Jesse
AMAnna N. Morozovska
Anna N. Morozovska
EEE. Eliseev
E. Eliseev
DCD. W. Chung
D. W. Chung
SKSergei Kalinin
Sergei Kalinin

1 May 2015 in Nano Letters
Verified
Journal Article
Closed access
ABAlex Belianinov
Alex Belianinov
Qian HeQian He
Qian He
ADAndrius Dziaugys
Andrius Dziaugys
PMP. Maksymovych
P. Maksymovych
EEE. Eliseev
E. Eliseev
SKSergei Kalinin
Sergei Kalinin

19 October 2007 in Nanotechnology
Verified
Journal Article
Closed access
Brian RodriguezBrian Rodriguez
Brian Rodriguez
CCClint Callahan
Clint Callahan
SKSergei Kalinin
Sergei Kalinin
RPRoger Proksch
Roger Proksch

26 April 2009 in Nature Materials
Verified
Journal Article
Closed access
PDF file
CYC.-H. Yang
C.-H. Yang
JSJan Seidel
Jan Seidel
SKS. Y. Kim
S. Y. Kim
PRP. B. Rossen
P. B. Rossen
PYP. Yu
P. Yu
RRR. Ramesh
R. Ramesh