- Mitra, N. *, Sarkar, P. K., Deb, S. and Basu Majumder, S., 2019. “Multiscale estimation of elastic constants of hydrated cement.”, Journal of Engineering Mechanics (ASCE; Q1, SCI, IF = 3.3), 145(4), p.04019014.
https://doi.org/10.1061/EM.1943-7889.0001582
- Sarkar, P.K. and Mitra, N. *, 2018. “Molecular mechanisms of tricalcium aluminate under tensile loads.” Computational Materials Science (ELSEVIER, Q1, SCI, IF = 3.3), 154, pp.547-556.
https://doi.org/10.1016/j.commatsci.2018.08.058
- Sarkar, P.K. and Mitra, N. *, 2019. “Gypsum under tensile loading: A molecular dynamics study.” Construction and Building Materials (ELSEVIER, Q1, SCI, IF= 8), 201, pp.1-10. https://doi.org/10.1016/j.conbuildmat.2018.12.097
- Sarkar, P.K. and Mitra, N. *, 2019. “Role of confined interstitial water in compressive response of calcium sulfate (CaSO4: nH2O)[n= 0, 0.5, 1].” Journal of Solid State Chemistry (ELSEVIER, Q2, SCI, IF = 3.5),274,188-198.
https://doi.org/10.1016/j.jssc.2019.03.024
- Sarkar, P.K. and Mitra, N. *, 2019. “Compressive response of tricalcium aluminate crystal: Molecular dynamics investigations.” Construction and Building Materials (ELSEVIER, Q1, SCI, IF = 8),224,188-197.
https://doi.org/10.1016/j.conbuildmat.2019.07.054
- Mitra, N. *, Sarkar, P.K. and Prasad, D., 2019. “Intermolecular dynamics of ultraconfined interlayer water in tobermorite: influence on mechanical performance.” Physical Chemistry Chemical Physics (ROYAL SOCIETY, Q1, WoS, IF = 2.9), 21, 11416-11423.
https://doi.org/10.1039/C9CP01285K
- Sarkar, P.K., Mitra, N*. and Prasad, D., 2019. “Molecular level Deformation mechanism of Ettringite.” Cement and Concrete Research (ELSEVIER, Q1, SCI, IF=13.1),124, p.105836.
https://doi.org/10.1016/j.cemconres.2019.105836
- Pal, Subhadeep, Mitra, N. *, Sarkar, P.K. and Prasad, D., 2020 “Stretch?induced helix to extended coil transition of crystalline α phase isotactic polypropylene: A molecular dynamics study [Including Journal Cover Page]” Polymer Crystallization (WILEY, Q3, Scopus), 3(4), e10143.
https://doi.org/10.1002/pcr2.10143
- Sarkar, P.K. and Mitra, N. *, 2021. “Molecular deformation response of portlandite under compressive loading.” Construction and Building Materials (ELSEVIER, Q1, SCI, IF = 8), 274,122020.
https://doi.org/10.1016/j.conbuildmat.2020.122020
- Sarkar, P.K. and Mitra, N. *, 2021. “Thermal conductivity of cement paste: Influence of macro-porosity” Cement and Concrete Research (ELSEVIER, Q1, SCI, IF = 13.1),143, 106385.
https://doi.org/10.1016/j.cemconres.2021.106385
- Sarkar, P.K., and Mitra, N. *, 2021. “Molecular level study of uni/multi-axial deformation response of tobermorite 11 A: A force field comparison study.” Cement and Concrete Research (ELSEVIER, Q1, SCI, IF = 13.1), 145, p.106451.
https://doi.org/10.1016/j.cemconres.2021.106451
- Sarkar, P.K*, Guido G. and Dolado J.S., 2023. “Thermal conductivity of Portlandite: Molecular dynamics based approach.” Cement and Concrete Research, (ELSEVIER, Q1, SCI, IF = 13.1), 175 (2024) p107347.
https://doi.org/10.1016/j.cemconres.2023.107347
- Sarkar, P.K*, Mitra, N. and Dolado J.S., 2024. “Thermal conductivity of layered minerals using molecular dynamics simulation: a case study on calcium sulfates.” Materials Today Communications, (ELSEVIER, Q2, Scopus, IF = 4.5), 38, 108101.
https://doi.org/10.1016/j.mtcomm.2024.108101
- Sarkar, P.K*, Guido G. and Dolado J.S., 2024. “Thermal properties of tricalcium aluminate: a molecular dynamic and experimental approach.” Cement and Concrete Research, (ELSEVIER, Q1, SCI, IF = 13.1), 189, 107780.
https://doi.org/10.1016/j.cemconres.2024.107780
- Sarkar, P.K*, Mitra, N. and Dolado J.S. 2025, “Reactive Molecular Dynamics based Multiaxial Failure Analysis of Jennite; Materialia (ELSEVIER, Q2, Scopus, IF = 2.9), 39, 102368.
https://doi.org/10.1016/j.mtla.2025.102368
Conference
- Sarkar, P.K., Ghosh, S., Chakraborty, S., “An efficient responses surface method for seismic fragility analysis of existing building frame.” (15SEE at IIT Roorkee Dec 2014, Paper No. A011)
Papers under preparation
Sarkar, P.K*, Agbaoye R. O., Dolado J.S., Nevshupa R., 2025. “Hydrogarnet: The main Hydrated Product of Calcium Aluminate Cement for Thermal Energy Storage Application” [Under DRAFTING]