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1 . Academic Journal
Many-body potential for simulating the self-assembly of polymer-grafted nanoparticles in a polymer matrix
저자
by
Yilong Zhou
;
Sigbjørn Løland Bore
;
Andrea R. Tao
;
Francesco Paesani
;
Gaurav Arya
.
소스
npj Computational Materials, Vol 9, Iss 1, Pp 1-14 (2023)
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7 . Academic Journal
Realistic phase diagram of water from 'first principles' data-driven quantum simulations
저자
by
Sigbjørn Løland Bore
;
Francesco Paesani
.
소스
Nature Communications, Vol 14, Iss 1, Pp 1-10 (2023)
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4 . Academic Journal
Structure and thermodynamics of water adsorption in NU-1500-Cr
저자
by
Ching-Hwa Ho
;
Mason L. Valentine
;
Zhijie Chen
;
Haomiao Xie
;
Omar Farha
, et al.
소스
Communications Chemistry, Vol 6, Iss 1, Pp 1-9 (2023)
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7 . Academic Journal
Elevating density functional theory to chemical accuracy for water simulations through a density-corrected many-body formalism
저자
by
Saswata Dasgupta
;
Eleftherios Lambros
;
John P. Perdew
;
Francesco Paesani
.
소스
Nature Communications, Vol 12, Iss 1, Pp 1-12 (2021)
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6 . Academic Journal
Hydrogen bonding structure of confined water templated by a metal-organic framework with open metal sites
저자
by
Adam J. Rieth
;
Kelly M. Hunter
;
Mircea Dincă
;
Francesco Paesani
.
소스
Nature Communications, Vol 10, Iss 1, Pp 1-7 (2019)
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6 . Academic Journal
Solvation-Guided Design of Fluorescent Probes for Discrimination of Amyloids
저자
by
Kevin J. Cao
;
Kristyna M. Elbel
;
Jessica L. Cifelli
;
Jordi Cirera
;
Christina J. Sigurdson
, et al.
소스
Scientific Reports, Vol 8, Iss 1, Pp 1-13 (2018)
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7 . Academic Journal
Electron affinity of liquid water
저자
by
Alex P. Gaiduk
;
Tuan Anh Pham
;
Marco Govoni
;
Francesco Paesani
;
Giulia Galli
.
소스
Nature Communications, Vol 9, Iss 1, Pp 1-6 (2018)
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7 . Academic Journal
Chemical accuracy in modeling halide ion hydration from many-body representations
저자
by
Francesco Paesani
;
Pushp Bajaj
;
Marc Riera
.
소스
Advances in Physics: X, Vol 4, Iss 1 (2019)
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5 .
Unveiling Unexpected Modulator-CO2 Dynamics within a Zirconium Metal–Organic Framework
저자
by
Thomas M. Rayder
;
Filip Formalik
;
Simon M. Vornholt
;
Hilliary Frank
;
Seryeong Lee
, et al.
소스
Journal of the American Chemical Society
. 145:11195-11205
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7 .
Connecting the dots for fundamental understanding of structure–photophysics–property relationships of COFs, MOFs, and perovskites using a Multiparticle Holstein Formalism
저자
by
Francesco Paesani
;
Raja Ghosh
.
소스
Chemical Science
. 14:1040-1064
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