Novel and transferable charge partitioning scheme using a deep neural network

Andrew Sifain; Nicholas Lubbers; Benjamin Nebgen; Justin Smith; Andrey Lokhov; Olexandr Isayev; Adrian Roitberg; Sergei Tretiak

Novel and transferable charge partitioning scheme using a deep neural network

Andrew Sifain
, Nicholas Lubbers
, Benjamin Nebgen
, Justin Smith
, Andrey Lokhov
, Olexandr Isayev
, Adrian Roitberg
, Sergei Tretiak

Los Alamos National Laboratory

Research output: Contribution to journal › Meeting Abstract

Original language	English
Journal	ACS National Meeting Book of Abstracts
Volume	256
State	Published - Aug 19 2018
Event	256th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nanoscience, Nanotechnology and Beyond - Duration: Aug 19 2018 → …

Cite this

@article{336c5123e28d49dbb5fdc7f4d4028b55,

title = "Novel and transferable charge partitioning scheme using a deep neural network",

author = "Andrew Sifain and Nicholas Lubbers and Benjamin Nebgen and Justin Smith and Andrey Lokhov and Olexandr Isayev and Adrian Roitberg and Sergei Tretiak",

year = "2018",

month = aug,

day = "19",

language = "English",

volume = "256",

journal = "ACS National Meeting Book of Abstracts",

issn = "0065-7727",

publisher = "American Chemical Society",

note = "256th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nanoscience, Nanotechnology and Beyond ; Conference date: 19-08-2018",

}

TY - JOUR

T1 - Novel and transferable charge partitioning scheme using a deep neural network

AU - Sifain, Andrew

AU - Lubbers, Nicholas

AU - Nebgen, Benjamin

AU - Smith, Justin

AU - Lokhov, Andrey

AU - Isayev, Olexandr

AU - Roitberg, Adrian

AU - Tretiak, Sergei

PY - 2018/8/19

Y1 - 2018/8/19

M3 - Meeting Abstract

SN - 0065-7727

VL - 256

JO - ACS National Meeting Book of Abstracts

JF - ACS National Meeting Book of Abstracts

T2 - 256th National Meeting and Exposition of the American-Chemical-Society (ACS) - Nanoscience, Nanotechnology and Beyond

Y2 - 19 August 2018

ER -