Automation of Active Space Selection for Multireference Methods via Machine Learning on Chemical Bond Dissociation. (Record no. 30693566)

MARC details
000 -LEADER
fixed length control field 00954 a2200253 4500
005 - DATE AND TIME OF LATEST TRANSACTION
control field 20250518090415.0
008 - FIXED-LENGTH DATA ELEMENTS--GENERAL INFORMATION
fixed length control field ####s 0 0 eng d
022 ## - INTERNATIONAL STANDARD SERIAL NUMBER
International Standard Serial Number 1549-9626
024 7# - OTHER STANDARD IDENTIFIER
Standard number or code 10.1021/acs.jctc.9b01297
Source of number or code doi
040 ## - CATALOGING SOURCE
Original cataloging agency NLM
Language of cataloging eng
Transcribing agency NLM
100 1# - MAIN ENTRY--PERSONAL NAME
Personal name Jeong, WooSeok
245 00 - TITLE STATEMENT
Title Automation of Active Space Selection for Multireference Methods via Machine Learning on Chemical Bond Dissociation.
Medium [electronic resource]
260 ## - PUBLICATION, DISTRIBUTION, ETC.
Name of publisher, distributor, etc. Journal of chemical theory and computation
Date of publication, distribution, etc. Apr 2020
300 ## - PHYSICAL DESCRIPTION
Extent 2389-2399 p.
Other physical details digital
500 ## - GENERAL NOTE
General note Publication Type: Journal Article
700 1# - ADDED ENTRY--PERSONAL NAME
Personal name Stoneburner, Samuel J
700 1# - ADDED ENTRY--PERSONAL NAME
Personal name King, Daniel
700 1# - ADDED ENTRY--PERSONAL NAME
Personal name Li, Ruye
700 1# - ADDED ENTRY--PERSONAL NAME
Personal name Walker, Andrew
700 1# - ADDED ENTRY--PERSONAL NAME
Personal name Lindh, Roland
700 1# - ADDED ENTRY--PERSONAL NAME
Personal name Gagliardi, Laura
773 0# - HOST ITEM ENTRY
Title Journal of chemical theory and computation
Related parts vol. 16
-- no. 4
-- p. 2389-2399
856 40 - ELECTRONIC LOCATION AND ACCESS
Uniform Resource Identifier <a href="https://doi.org/10.1021/acs.jctc.9b01297">https://doi.org/10.1021/acs.jctc.9b01297</a>
Public note Available from publisher's website

No items available.