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Chemical Theory, Models and Computational Methods  (CTMC)


CONTACTS

Name Email Phone Room
Evelyn  Goldfield egoldfie@nsf.gov (703) 292-2173  1055 S  
Robert  Cave rjcave@nsf.gov (703) 292-2394  1055.11  
Susan  Atlas satlas@nsf.gov (703) 292-4336  1055.23  


PROGRAM GUIDELINES

Apply to PD 09-6881 as follows:

For full proposals submitted via FastLane: standard NSF Proposal & Award Policies & Procedures Guide proposal preparation guidelines apply.
For full proposals submitted via Grants.gov: the NSF Grants.gov Application Guide: A Guide for the Preparation and Submission of NSF Applications via Grants.gov Guidelines applies. (Note: The NSF Grants.gov Application Guide is available on the Grants.gov website and on the NSF website at: http://www.nsf.gov/publications/pub_summ.jsp?ods_key=grantsgovguide)

Important Information for Proposers

A revised version of the NSF Proposal & Award Policies & Procedures Guide (PAPPG) (NSF 17-1), is effective for proposals submitted, or due, on or after January 30, 2017. Please be advised that, depending on the specified due date, the guidelines contained in NSF 17-1 may apply to proposals submitted in response to this funding opportunity.


DUE DATES

Full Proposal Window

    September 1, 2017 - October 2, 2017

    September 1 - September 30, Annually Thereafter

    September 1, 2018 - October 1, 2018

    September 1 - September 30, Annually Thereafter

Note that if the last day of a submission window falls on a weekend or official Federal government holiday, the deadline is always the following business day, at 5 pm local time.


SYNOPSIS

The Chemical Theory, Models, and Computational Methods Program supports the discovery and development of theoretical and computational methods or models to address a range of chemical challenges, with emphasis on emerging areas of chemical research.  Proposals that focus on established theoretical or computational approaches should involve innovations that substantially broaden their applicability.  Areas of interest include, but are not limited to, electronics structure, quantum reaction dynamics, theoretical/computational spectroscopy, statistical mechanics, molecular dynamics and simulation, and modeling techniques for isolated molecular systems and systems in complex environments.  Areas of application span the full range of chemical systems from single molecules to mesoscopic aggregates.  Proposals that develop approaches to bridge multiple spatial or temporal scales are welcome.  Despite the diverse application areas, the goal of the program is to support the development of new theoretical and computational methodologies that are broadly applicable to a range of challenging chemical problems.  The CTMC Program is interested in fundamental areas of chemical research that are difficult or impossible to address using current synthetic, experimental, and/or computational methodologies.

We encourage proposals that address emerging areas in theoretical and computational chemistry, including proposals that involve novel approaches based on machine learning or other data-enabled methods with broad applicability to significant chemical problems.  We also encourage proposals on quantum information science (QIS) that either focus on applying QIS concepts to theoretical and computational chemistry or on developing quantum algorithms for chemical systems.

The CTMC Program encourages the integration of innovative software development with methodological and algorithmic development, especially computational approaches that allow efficient utilization of emerging computer architectures.  Such proposals may be submitted to the CTMC Program either directly or through the Computational and Data Science and Engineering (CDS&E) funding opportunity: https://www.nsf.gov/funding/pgm_summ.jsp?pims_id=504813.

Note: Relevant proposals should have a title starting with “CDS&E:” to be distinguished from other CTMC proposals.

Proposals that utilize established theoretical and modeling approaches to solve problems in chemistry without significant theoretical or methodological development, or that focus on the development of biology or materials design may be more appropriate for other programs in either the Chemistry Division or in other NSF Divisions or Directorates.


What Has Been Funded (Recent Awards Made Through This Program, with Abstracts)

Map of Recent Awards Made Through This Program

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