Search

Categories

Analytical Chemistry

(1)

Earth, Space, and Environmental Chemistry

(1)

Materials Chemistry

(1)

Organic Chemistry

(1)

Theoretical and Computational Chemistry

(1)

Content Types

Working Paper

(3)

Published Date

Over 3 years

(2)

Last 3 years

(1)

Keywords

Authors

Peter O'Brien

3 results in Authors: Peter O'Brien

Theoretical and Computational Chemistry

Psi4 1.4: Open-Source Software for High-Throughput Quantum Chemistry

Daniel Smith, Lori Burns, Andrew Simmonett, Robert Parrish, Matthew Schieber, Raimondas Galvelis, Peter Kraus, Holger Kruse, Roberto Di Remigio, Asem Alenaizan, Andrew James, Susi Lehtola, Jonathon Misiewicz, Maximilian Scheurer, Robert Shaw, Jeffrey Schriber, Yi Xie, Zachary Glick, Dominic Sirianni, Joseph O'Brien, Jonathan Waldrop, Ashutosh Kumar, Edward G. Hohenstein, Benjamin Pritchard, Bernard Brooks, Henry Schaefer, Alexander Sokolov, Konrad Patkowski, Eugene DePrince, Ugur Bozkaya, Rollin King, Francesco Evangelista, Justin Turney, Thomas Crawford, David Sherrill

Version 1 posted 05 March 2020

1,786

Downloads

4

Citations

Organic Chemistry

Organolithium Gels – Simple Easily Divided Delivery Vehicles for Highly Reactive Species

Petr Slavik, Peter O'Brien, David Smith

Version 1 posted 18 February 2022

1,115

Downloads

Analytical Chemistry

Naive Bayes classification model for isotopologue detection in LC-HRMS data

Denice van Herwerden, Jake O'Brien, Phil Choi, Kevin Thomas, Peter Schoenmakers, Saer Samanipour

Version 1 posted 03 November 2021

269

Downloads